P56817
BACE1 — Beta-secretase 1
Lists of molecules and drugs that interact with protein P56817
| DrugDomain Data | DrugBank ID | PDB Ligand | Ligand Name | ChEMBL | PubChem | InChIKey |
|---|---|---|---|---|---|---|
| Explore | DB01093 | DMS | DIMETHYL SULFOXIDE | CHEMBL504 | 679 | IAZDPXIOMUYVGZ-UHFFFAOYSA-N |
| Explore | DB01694 | TAR | D(-)-TARTARIC ACID | CHEMBL1200861 | 439655 | FEWJPZIEWOKRBE-LWMBPPNESA-N |
| Explore | DB02325 | IPA | ISOPROPYL ALCOHOL | CHEMBL582 | 3776 | KFZMGEQAYNKOFK-UHFFFAOYSA-N |
| Explore | DB02378 | MMI | N-[(4S,5S,7R)-8-({(S)-1-[(BENZYLAMINO)OXOMETHYL]-2-METHYLPROPYL}AMINO)-5-HYDROXY-2,7-DIMETHYL-8-OXO-OCT-4-YL]-(4S,7S)-4 -ISOPROPYL-2,5,9-TRIOXO-1-OXA-3,6,10-TRIAZACYCLOHEXADECANE-7-CARBOXAMIDE | CHEMBL362592 | 449218 | QJAPFAZHNSZLJE-CWURXVSKSA-N |
| Explore | DB03904 | URE | UREA | CHEMBL985 | 1176 | XSQUKJJJFZCRTK-UHFFFAOYSA-N |
| Explore | DB06930 | 251 | N-[amino(imino)methyl]-2-(2,5-diphenyl-1H-pyrrol-1-yl)acetamide | CHEMBL217068 | 11290116;137628959 | WVLDNAVUCUAGDP-UHFFFAOYSA-N |
| Explore | DB07019 | 35A | N-[(5R,14R)-5-AMINO-5,14-DIMETHYL-4-OXO-3-OXA-18-AZATRICYCLO[15.3.1.1~7,11~]DOCOSA-1(21),7(22),8,10,17,19-HEXAEN-19-YL]-N-METHYLMETHANESULFONAMIDE | None | 24768527 | QWDOKZPZLWNULU-MZNJEOGPSA-N |
| Explore | DB07089 | 462 | N-[amino(imino)methyl]-2-[2-(2-chlorophenyl)-4-(4-propoxyphenyl)-3-thienyl]acetamide | CHEMBL391087 | 11995761;137629174 | VZSMTBLDWPKVRW-UHFFFAOYSA-N |
| Explore | DB07110 | 4FP | 4-(4-FLUOROBENZYL)PIPERIDINE | CHEMBL144527 | 3699841 | JLAKCHGEEBPDQI-UHFFFAOYSA-N |
| Explore | DB07175 | 5MS | N-{2-methyl-5-[(6-phenylpyrimidin-4-yl)amino]phenyl}methanesulfonamide | CHEMBL469117 | 25138203 | CXQRKICWSCAUGW-UHFFFAOYSA-N |
| Explore | DB07206 | 6IP | 6-[2-(1H-INDOL-6-YL)ETHYL]PYRIDIN-2-AMINE | CHEMBL221118 | 11586735 | OSHSZKRWKLQZBV-UHFFFAOYSA-N |
| Explore | DB07245 | 7IP | 6-[2-(3'-METHOXYBIPHENYL-3-YL)ETHYL]PYRIDIN-2-AMINE | CHEMBL221170 | 11659487 | AEVBKBAFFJKFJZ-UHFFFAOYSA-N |
| Explore | DB07281 | 8AP | N~3~-BENZYLPYRIDINE-2,3-DIAMINE | CHEMBL435747 | 10397869 | MUKAGFLFIMVSQN-UHFFFAOYSA-N |
| Explore | DB07284 | 8IP | N~3~-(3-PYRIDIN-3-YLBENZYL)PYRIDINE-2,3-DIAMINE | CHEMBL220346 | 11701820 | NQSBHBFOOVYRNM-UHFFFAOYSA-N |
| Explore | DB07303 | 9IP | N~3~-[3-(5-METHOXYPYRIDIN-3-YL)BENZYL]PYRIDINE-2,3-DIAMINE | CHEMBL220396 | 11500493 | PGAWZMRRCVSRIM-UHFFFAOYSA-N |
| Explore | DB07345 | AED | 4-(2-aminoethyl)-2-cyclohexylphenol | CHEMBL404150 | 24748051 | DOCCSEDGBYCYLS-UHFFFAOYSA-N |
| Explore | DB07346 | AEH | 4-(2-aminoethyl)-2-ethylphenol | CHEMBL255750 | 24748050 | LDAFQVRTSOETPE-UHFFFAOYSA-N |
| Explore | DB07415 | B35 | 4-[(1S)-1-(3-fluoro-4-methoxyphenyl)-2-(2-methoxy-5-nitrophenyl)ethyl]-1H-imidazol-2-amine | None | 42628075 | RFLOFHKRBGKCOB-AWEZNQCLSA-N |
| Explore | DB07519 | C27 | (6R)-2-amino-6-[2-(3'-methoxybiphenyl-3-yl)ethyl]-3,6-dimethyl-5,6-dihydropyrimidin-4(3H)-one | CHEMBL239857 | 16040323 | VDFBMQAUECXNKR-OAQYLSRUSA-N |
| Explore | DB07535 | C8C | 2-amino-6-[2-(1H-indol-6-yl)ethyl]pyrimidin-4(3H)-one | CHEMBL236777 | 11651760;135424789 | VRAZIAJSKFRSIP-UHFFFAOYSA-N |
| Explore | DB07573 | CMZ | (2S)-1-(2,5-dimethylphenoxy)-3-morpholin-4-ylpropan-2-ol | None | 831616 | HVMGGHDPXHODHE-AWEZNQCLSA-N |
| Explore | DB07734 | F1H | N-(1-benzylpiperidin-4-yl)-4-sulfanylbutanamide | None | 25134249 | XNIXPLIQGKQSIE-UHFFFAOYSA-N |
| Explore | DB07735 | F1I | N-[1-(2,6-dimethoxybenzyl)piperidin-4-yl]-4-sulfanylbutanamide | None | 25134250 | MUDVORCZGBAHNA-UHFFFAOYSA-N |
| Explore | DB07736 | F1J | (2S)-4-(4-fluorobenzyl)-N-(2-sulfanylethyl)piperazine-2-carboxamide | None | 25134251 | CEXXKSSFAKABEN-ZDUSSCGKSA-N |
| Explore | DB07737 | F1K | (2S)-4-(4-fluorobenzyl)-N-(3-sulfanylpropyl)piperazine-2-carboxamide | None | 25134252 | OYTFYWWLBPDTNS-AWEZNQCLSA-N |
| Explore | DB07738 | F1L | N-[1-(5-bromo-2,3-dimethoxybenzyl)piperidin-4-yl]-4-sulfanylbutanamide | None | 25134253 | HESMISSJMKCCAV-UHFFFAOYSA-N |
| Explore | DB07874 | H24 | (6S)-2-amino-6-(3'-methoxybiphenyl-3-yl)-3,6-dimethyl-5,6-dihydropyrimidin-4(3H)-one | CHEMBL1233206 | 17749735 | LQOCXPOKEPYGTJ-IBGZPJMESA-N |
| Explore | DB07993 | IP6 | N~3~-[3-(1H-INDOL-6-YL)BENZYL]PYRIDINE-2,3-DIAMINE | CHEMBL220896 | 11507920 | LPQUIIHPUGDHJK-UHFFFAOYSA-N |
| Explore | DB07994 | IP7 | N~3~-[5-(1H-INDOL-6-YL)-2-(PYRIDIN-2-YLMETHOXY)BENZYL]PYRIDINE-2,3-DIAMINE | CHEMBL220428 | 11633167 | KMBPJSHPAXOXBT-UHFFFAOYSA-N |
| Explore | DB08749 | XX4 | 3-(2-AMINO-6-BENZOYLQUINAZOLIN-3(4H)-YL)-N-CYCLOHEXYL-N-METHYLPROPANAMIDE | CHEMBL244342 | 16741238 | KTRFBFMYAJOXLG-UHFFFAOYSA-N |
| Explore | DB08841 | AEF | 4-(2-aminoethyl)phenol | CHEMBL11608 | 5610 | DZGWFCGJZKJUFP-UHFFFAOYSA-N |
| Explore | DB09459 | TLA | L(+)-TARTARIC ACID | CHEMBL1236315 | 444305 | FEWJPZIEWOKRBE-JCYAYHJZSA-N |
| Explore | DB09462 | GOL | GLYCEROL | CHEMBL692 | 753 | PEDCQBHIVMGVHV-UHFFFAOYSA-N |
| Explore | DB12285 | 66F | N-{3-[(5R)-3-amino-2,5-dimethyl-1,1-dioxido-5,6-dihydro-2H-1,2,4-thiadiazin-5-yl]-4-fluorophenyl}-5-fluoropyridine-2-carboxamide | CHEMBL3301601 | 51352361 | YHYKUSGACIYRML-KRWDZBQOSA-N |
| Explore | DB12368 | 32D | (1S)-1-[2-(difluoromethyl)pyridin-4-yl]-4-fluoro-1-(3-pyrimidin-5-ylphenyl)-1H-isoindol-3-amine | CHEMBL2177913 | 46202416 | MRXBCEQZNKUUIP-DEOSSOPVSA-N |
| Explore | DB12547 | 3YS | N-{3-[(4aS,7aS)-2-amino-4a,5-dihydro-4H-furo[3,4-d][1,3]thiazin-7a(7H)-yl]-4-fluorophenyl}-5-fluoropyridine-2-carboxamide | CHEMBL2396989 | 49837968 | NIDRNVHMMDAAIK-YPMLDQLKSA-N |
| Explore | DB13065 | 4B2 | (4S)-4-[2,4-difluoro-5-(pyrimidin-5-yl)phenyl]-4-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine | CHEMBL2333941 | 44251605 | MJQMRGWYPNIERM-HNNXBMFYSA-N |
| Explore | DB14511 | ACT | ACETATE ION | None | 175 | QTBSBXVTEAMEQO-UHFFFAOYSA-M |
| Explore | DB14523 | PO4 | PHOSPHATE ION | None | 1061 | NBIIXXVUZAFLBC-UHFFFAOYSA-K |
| Explore | DB14546 | SO4 | SULFATE ION | None | 1117 | QAOWNCQODCNURD-UHFFFAOYSA-L |
| Explore | DB15307 | H3C | N-[3-[(4S)-2-azanyl-4-methyl-1,3-thiazin-4-yl]-4-fluoranyl-phenyl]-5-cyano-pyridine-2-carboxamide | CHEMBL3916243 | 68254185 | VLLFGVHGKLDDLW-SFHVURJKSA-N |
| Explore | None | 009 | (4S)-1,4-dibenzyl-N-[(1S,2R)-1-benzyl-3-{[3-(dimethylamino)benzyl]amino}-2-hydroxypropyl]-2-oxoimidazolidine-4-carboxamide | CHEMBL406317 | 24801865 | DCJGHBWTJFHQCR-UEHMVRIRSA-N |
| Explore | None | 012 | (4S)-N-[(1S,2R)-1-benzyl-3-{[3-(dimethylamino)benzyl]amino}-2-hydroxypropyl]-1-(3-methoxybenzyl)-2-oxoimidazolidine-4-carboxamide | CHEMBL261655 | 24801864 | MCBWJRZWLSXSBN-YTCPBCGMSA-N |
| Explore | None | 038 | 3-[[(2S)-2-[[[(2S)-2-[[(2S)-2-[[(2S)-2-azanyl-3-(1H-1,2,3,4-tetrazol-5-ylcarbonylamino)propanoyl]amino]-3-methyl-butanoyl]amino]-4-methyl-pentanoyl]amino]methyl]-2-hydroxy-4-phenyl-butanoyl]amino]benzoic acid | CHEMBL1229518 | 49817351 | FZZOBXKGDCMGAL-NAJARDBOSA-N |
| Explore | None | 091 | (3S)-spiro[indole-3,3'-pyrrolidin]-2(1H)-one | CHEMBL2181988 | 56940703 | FQSHLSLQUHZOMV-LLVKDONJSA-N |
| Explore | None | 092 | methyl (3S,5'R)-2-oxo-1,2-dihydrospiro[indole-3,3'-pyrrolidine]-5'-carboxylate | CHEMBL2181997 | 56940704 | WBRZAMFFUKWSQR-ZWNOBZJWSA-N |
| Explore | None | 095 | tetrahydro-2H-pyran-4-yl (3S,5'R)-2-oxo-1,2-dihydrospiro[indole-3,3'-pyrrolidine]-5'-carboxylate | CHEMBL2181998 | 56940705 | HIOAPSYSJQPIRC-RHSMWYFYSA-N |
| Explore | None | 09A | benzyl (3S,5'R)-2-oxo-1,2-dihydrospiro[indole-3,3'-pyrrolidine]-5'-carboxylate | CHEMBL2181979 | 56940706 | WDDNNMQSTPFSMZ-VQIMIIECSA-N |
| Explore | None | 09B | 4-cyanobenzyl (3S,5'R)-2-oxo-1,2-dihydrospiro[indole-3,3'-pyrrolidine]-5'-carboxylate | CHEMBL2181980 | 56940707 | QVGGPTMZUCXDDT-YLJYHZDGSA-N |
| Explore | None | 09D | (4S)-6-bromo-3,4-dihydro-2H-thiochromen-4-yl (3S,5'R)-2-oxo-1,2-dihydrospiro[indole-3,3'-pyrrolidine]-5'-carboxylate | None | 56940708 | OPUJSFZMYKHRTH-LLGFUMIMSA-N |
| Explore | None | 09E | (4S)-6-bromo-1,1-dioxido-3,4-dihydro-2H-thiochromen-4-yl (3S,5'R)-2-oxo-1,2-dihydrospiro[indole-3,3'-pyrrolidine]-5'-carboxylate | None | 56940709 | AENVIUXFIDGFED-LLGFUMIMSA-N |
| Explore | None | 09F | 1-cyanocyclohexyl (3S,5'R)-2-oxo-1,2-dihydrospiro[indole-3,3'-pyrrolidine]-5'-carboxylate | CHEMBL2181985 | 56940710 | VRCMTLQTPNLTIN-DNVCBOLYSA-N |
| Explore | None | 09G | 3-bromo-4-cyanobenzyl (3S,5'R)-2-oxo-1,2-dihydrospiro[indole-3,3'-pyrrolidine]-5'-carboxylate | CHEMBL2181982 | 56940711 | DJYALAFSFGHFLN-YLJYHZDGSA-N |
| Explore | None | 0B1 | 2-amino-6-[(1S,2R)-2-(3'-methoxybiphenyl-3-yl)cyclopropyl]-3-methylpyrimidin-4(3H)-one | CHEMBL2169933 | 66545743 | QECXNBWGUGUPSI-ROUUACIJSA-N |
| Explore | None | 0B3 | (6R)-2-amino-3,6-dimethyl-6-(2-phenylethyl)-5,6-dihydropyrimidin-4(3H)-one | CHEMBL3040447 | 71737800 | NHJCZSSEYRWDOJ-CQSZACIVSA-N |
| Explore | None | 0B4 | (6S)-2-amino-3,6-dimethyl-6-[(1R,2R)-2-phenylcyclopropyl]-5,6-dihydropyrimidin-4(3H)-one | CHEMBL3040534 | 71737801 | YBXYDJCRBQOXMI-ZOWXZIJZSA-N |
| Explore | None | 0B5 | ~{N}-[3-[(4~{R},5~{R},6~{S})-2-azanyl-6-[1,1-bis(fluoranyl)ethyl]-5-fluoranyl-4-methyl-5,6-dihydro-1,3-oxazin-4-yl]-4-fluoranyl-phenyl]-5-(fluoranylmethoxy)pyrazine-2-carboxamide | CHEMBL4226994 | 118440826 | DKIWJWSKVCKJPV-RLFYNMQTSA-N |
| Explore | None | 0B6 | ~{N}-[3-[(4~{S})-2-azanyl-6-(fluoranylmethyl)-4-methyl-1,3-oxazin-4-yl]-4-fluoranyl-phenyl]-5-cyano-pyridine-2-carboxamide | CHEMBL4213486 | 71466345 | ORHZQSYKGHHDOP-IBGZPJMESA-N |
| Explore | None | 0BI | (4S)-4-[(1R)-1-hydroxy-2-({1-[3-(1-methylethyl)phenyl]cyclopropyl}amino)ethyl]-19-(methoxymethyl)-11-oxa-3,16-diazatric yclo[15.3.1.1~6,10~]docosa-1(21),6(22),7,9,17,19-hexaen-2-one | CHEMBL595066 | 44631842 | GCZHKZTYTMTFGU-JHOUSYSJSA-N |
| Explore | None | 0EW | N-{3-[(2S,5R)-6-amino-5-(ethanesulfonyl)-2-(fluoromethyl)-5-methyl-2,3,4,5-tetrahydropyridin-2-yl]-4-fluorophenyl}-2,2-difluoro-2H-[1,3]dioxolo[4,5-c]pyridine-6-carboxamide | CHEMBL5092328 | 156612914 | NDIQAOIHFVWZJQ-NHCUHLMSSA-N |
| Explore | None | 0GH | N-[(2S)-1-({(2S,3R)-3-hydroxy-1-[(2-methylpropyl)amino]-1-oxobutan-2-yl}amino)-3-phenylpropan-2-yl]-5-[methyl(methylsulfonyl)amino]-N'-[(1R)-1-phenylethyl]benzene-1,3-dicarboxamide | CHEMBL2179132 | n/a | UZFAOTIMARRSKT-TYUOOWEOSA-N |
| Explore | None | 0GO | (2S)-N-[(2S,3R)-3-hydroxy-1-phenyl-4-{[3-(propan-2-yl)benzyl]amino}butan-2-yl]-2-[(5S)-6-oxo-1-propyl-1,7-diazaspiro[4.4]non-7-yl]propanamide | CHEMBL2047887 | 66575075 | MOXAMLWWFJKUEH-XGZLTPBASA-N |
| Explore | None | 0GS | (3S,4S,5R)-3-(4-amino-3-bromo-5-fluorobenzyl)-5-{[3-(1,1-difluoroethyl)benzyl]amino}tetrahydro-2H-thiopyran-4-ol 1,1-dioxide | CHEMBL2047891 | 57386813 | QBRKIXCNLLQOPH-WNYOCNMUSA-N |
| Explore | None | 0GT | (3R,4S,5S)-3-[(3-tert-butylbenzyl)amino]-5-{[3-(2,2-difluoroethyl)-1H-indol-5-yl]methyl}tetrahydro-2H-thiopyran-4-ol 1,1-dioxide | CHEMBL2047898 | 57387067 | OOZZVYSXZBAROL-PSUQPPDWSA-N |
| Explore | None | 0GU | (3R,4S,5S)-3-[(3-tert-butylbenzyl)amino]-5-[(4,4,7'-trifluoro-1',2'-dihydrospiro[cyclohexane-1,3'-indol]-5'-yl)methyl]tetrahydro-2H-thiopyran-4-ol 1,1-dioxide | CHEMBL2047901 | 57387070 | YSVPVGYQIWTLEZ-UDZXTKBFSA-N |
| Explore | None | 0K9 | (2R)-N-{(2S,3R)-4-{[(4'S)-6'-(2,2-dimethylpropyl)-3',4'-dihydrospiro[cyclobutane-1,2'-pyrano[2,3-b]pyridin]-4'-yl]amino}-3-hydroxy-1-[3-(1,3-thiazol-2-yl)phenyl]butan-2-yl}-2-methoxypropanamide | CHEMBL2181911 | 60202321 | IUSARDYWEPUTPN-OZBXUNDUSA-N |
| Explore | None | 0KK | (2E)-2-imino-3-methyl-5,5-diphenylimidazolidin-4-one | CHEMBL291784 | 15054176 | RNWLAFWLSSMCLN-UHFFFAOYSA-N |
| Explore | None | 0KM | (2E,5R)-2-imino-5-(3'-methoxybiphenyl-3-yl)-3-methyl-5-phenylimidazolidin-4-one | CHEMBL2011981 | 70681036 | LRYKHTDVFXMHEH-HSZRJFAPSA-N |
| Explore | None | 0KN | (2R)-N-[(2S,3R)-1-(1,3-benzodioxol-5-yl)-4-{[(4'S)-6'-(2,2-dimethylpropyl)-3',4'-dihydrospiro[cyclobutane-1,2'-pyrano[2,3-b]pyridin]-4'-yl]amino}-3-hydroxybutan-2-yl]-2-methoxypropanamide | CHEMBL2181880 | 56940718 | OMMVFRZSBCRMQD-LJYZBVLISA-N |
| Explore | None | 0KP | (2E,5R)-2-imino-3-methyl-5-phenyl-5-[3-(pyridin-3-yl)phenyl]imidazolidin-4-one | CHEMBL2011983 | 70685236 | PNSQCPQDRVOKMA-OAQYLSRUSA-N |
| Explore | None | 0KQ | (2E,5R)-5-[3-(5-chloropyridin-3-yl)phenyl]-5-cyclopropyl-2-imino-3-methylimidazolidin-4-one | CHEMBL2011965 | 59388465 | SZDQNTKTWBPIBH-GOSISDBHSA-N |
| Explore | None | 0KR | (2E,5R)-5-cyclopropyl-2-imino-3-methyl-5-{3-[5-(prop-1-yn-1-yl)pyridin-3-yl]phenyl}imidazolidin-4-one | CHEMBL2012070 | 57404339 | HORHMTMHXZJNQJ-OAQYLSRUSA-N |
| Explore | None | 0LG | N-[(4S,8E,11S)-4-[(1R)-1-hydroxy-2-{[3-(propan-2-yl)benzyl]amino}ethyl]-2,13-dioxo-11-phenyl-6-oxa-3,12-diazabicyclo[12.3.1]octadeca-1(18),8,14,16-tetraen-16-yl]-N-methylmethanesulfonamide | CHEMBL2047040 | 57345931 | XYJDOUBLYLOJJL-YNYOQIOBSA-N |
| Explore | None | 0MP | N-((2S,3R)-1-(4-fluorophenyl)-3-hydroxy-4-((6'-neopentyl-3',4'-dihydrospiro[cyclobutane-1,2'-pyrano[2,3-b]pyridin]-4'-yl)amino)butan-2-yl)acetamide | CHEMBL2030997 | 60202322 | FBJQDUYQPYABBR-CCDWMCETSA-N |
| Explore | None | 0N1 | (4S,8E,11R)-4-[(1R)-1-hydroxy-2-{[3-(propan-2-yl)benzyl]amino}ethyl]-16-methyl-11-phenyl-6-oxa-3,12-diazabicyclo[12.3.1]octadeca-1(18),8,14,16-tetraene-2,13-dione | CHEMBL2047045 | 57345932 | BEGCWPHKTGGGNN-HOQOQLLYSA-N |
| Explore | None | 0QQ | N-[3-[(4R,5R,6R)-2-azanyl-5-fluoranyl-4,6-dimethyl-5,6-dihydro-1,3-thiazin-4-yl]-4-fluoranyl-phenyl]-2,3-dihydro-[1,4]dioxino[2,3-c]pyridine-7-carboxamide | CHEMBL5075689 | 162366968 | LQVIUEMPEFSVOL-CPRIZNHFSA-N |
| Explore | None | 0U4 | N-[(2S,3R)-4-{[2-(1-benzylpiperidin-4-yl)ethyl]amino}-3-hydroxy-1-phenylbutan-2-yl]-5-[methyl(methylsulfonyl)amino]-N'-[(1R)-1-phenylethyl]benzene-1,3-dicarboxamide | CHEMBL510269 | 44123817 | IMNAYTZSJCRZIO-RLRCJDGOSA-N |
| Explore | None | 0UP | 4-{[(5R,7S)-1-(3-fluorophenyl)-3,7-dimethyl-2,2-dioxido-2-thia-1,3,8-triazaspiro[4.5]dec-8-yl]methyl}-2-(propan-2-yloxy)phenol | CHEMBL2177470 | 44514742 | UICGCQDWRACUBV-MHECFPHRSA-N |
| Explore | None | 0UQ | (5R,7S)-1-(3-fluorophenyl)-3,7-dimethyl-8-[3-(propan-2-yloxy)benzyl]-2-thia-1,3,8-triazaspiro[4.5]decane 2,2-dioxide | CHEMBL2177473 | 58157954 | CVPXZTQJPHYLAQ-YADARESESA-N |
| Explore | None | 0V6 | (2Z,6S)-6-{3-chloro-5-[5-(prop-1-yn-1-yl)pyridin-3-yl]thiophen-2-yl}-2-imino-3,6-dimethyltetrahydropyrimidin-4(1H)-one | CHEMBL2151181 | 66575082 | IJYPXSRDUPWKPB-SFHVURJKSA-N |
| Explore | None | 0VA | N-[N-(4-amino-3,5-dichlorobenzyl)carbamimidoyl]-3-(4-methoxyphenyl)-5-methyl-1,2-thiazole-4-carboxamide | CHEMBL2178178 | 58962911 | DPJQBOWFYJTIJB-UHFFFAOYSA-N |
| Explore | None | 0VB | N-{N-[4-(acetylamino)-3-chloro-5-methylbenzyl]carbamimidoyl}-3-(4-methoxyphenyl)-5-methyl-1,2-thiazole-4-carboxamide | CHEMBL2178181 | 11983210 | MQPJKTGBSCCWTI-UHFFFAOYSA-N |
| Explore | None | 0XA | (4S,8E)-4-[(1R)-2-{[2-(5-tert-butyl-1,3-oxazol-2-yl)propan-2-yl]amino}-1-hydroxyethyl]-16-methyl-6-oxa-3-azabicyclo[12.3.1]octadeca-1(18),8,14,16-tetraene-2,13-dione | None | 71677787 | PYRAVCNCGMDZRY-BDCWSOESSA-N |
| Explore | None | 0ZA | 3-{(1S)-1-[(6-chloro-3,3-dimethyl-3,4-dihydroisoquinolin-1-yl)amino]-2-phenylethyl}-1,2,4-oxadiazol-5(2H)-one | CHEMBL2346796 | 135566781;70789278 | XREOSEVJCQGCHE-KRWDZBQOSA-N |
| Explore | None | 10J | 3-{5-[(2E,4aR,7aR)-6-benzoyl-2-imino-3-methyl-4-oxooctahydro-7aH-pyrrolo[3,4-d]pyrimidin-7a-yl]thiophen-3-yl}benzonitrile | CHEMBL2178145 | 60210990 | POOXGNGZUXTIQE-CPJSRVTESA-N |
| Explore | None | 10O | 3-{5-[(2E,4aR,7aR)-2-imino-6-(6-methoxypyridin-2-yl)-3-methyl-4-oxooctahydro-7aH-pyrrolo[3,4-d]pyrimidin-7a-yl]thiophen-3-yl}benzonitrile | CHEMBL2178715 | 66557874 | DHDYCYIAHXOSEU-UUOWRZLLSA-N |
| Explore | None | 10Q | 2-{(2E,4aR,7aR)-7a-[4-(3-cyanophenyl)thiophen-2-yl]-2-imino-3-methyl-4-oxooctahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl}pyridine-3-carbonitrile | CHEMBL2178713 | 66557875 | LWVMTILRDSZVMA-CYFREDJKSA-N |
| Explore | None | 10V | 3-{5-[(2E,4aR,7aR)-2-imino-6-(3-methoxypyridin-2-yl)-3-methyl-4-oxooctahydro-7aH-pyrrolo[3,4-d]pyrimidin-7a-yl]thiophen-3-yl}benzonitrile | CHEMBL2178712 | 66557876 | OVZBZLASXPSCEA-UUOWRZLLSA-N |
| Explore | None | 10W | 2-fluoro-5-{5-[(2E,4aR,7aR)-2-imino-3-methyl-4-oxo-6-phenyloctahydro-7aH-pyrrolo[3,4-d]pyrimidin-7a-yl]thiophen-2-yl}benzonitrile | CHEMBL2178148 | 60210991 | DWVJKKOFIHHAKC-UUOWRZLLSA-N |
| Explore | None | 13W | 3-{5-[(2E,4S)-2-imino-1,4-dimethyl-6-oxohexahydropyrimidin-4-yl]thiophen-3-yl}benzonitrile | CHEMBL2151138 | 11631207 | MLNWGLXMDFUREO-KRWDZBQOSA-N |
| Explore | None | 18P | N-{3-[(2R)-6-amino-2,4-dimethyl-3-oxo-2,3,4,5-tetrahydropyrazin-2-yl]phenyl}-5-chloropyridine-2-carboxamide | CHEMBL1923160 | 53481984 | MRYFMHAPTQCQLE-GOSISDBHSA-N |
| Explore | None | 1B1 | (2R)-2-cyclopropyl-5-methyl-2-[3-(5-prop-1-yn-1-ylpyridin-3-yl)phenyl]-2H-imidazol-4-amine | None | 137347946 | TWHSRVVFCICXII-OAQYLSRUSA-N |
| Explore | None | 1B7 | N-(6-chloro-3,3-dimethyl-3,4-dihydroisoquinolin-1-yl)-3-(4-propylthiophen-3-yl)-L-alanine | None | 135566782;71737824 | SFUUSYIYAKSHRW-SFHVURJKSA-N |
| Explore | None | 1B8 | 3-[2-bromo-4-(1H-pyrazol-4-yl)thiophen-3-yl]-N-(6-chloro-3,3-dimethyl-3,4-dihydroisoquinolin-1-yl)-L-alanine | None | 135566783;70789279 | DZVYKFXCGGLAAX-KRWDZBQOSA-N |
| Explore | None | 1B9 | 3-(4-bromothiophen-3-yl)-N-(6-chloro-3,3-dimethyl-3,4-dihydroisoquinolin-1-yl)-L-alanine | None | 135566785;70789281 | LZMNPXMCRBRYAN-HNNXBMFYSA-N |
| Explore | None | 1BB | 2-{(1S)-1-[(6-chloro-3,3-dimethyl-3,4-dihydroisoquinolin-1-yl)amino]-2-phenylethyl}-4-oxo-1,4-dihydropyrimidine-5-carbonitrile | CHEMBL2346802 | 135566786;70789284 | SSQLUPVACAMCTQ-FQEVSTJZSA-N |
| Explore | None | 1BC | 2-{(1S)-1-{[(1Z)-6-chloro-3,3-dimethyl-3,4-dihydroisoquinolin-1(2H)-ylidene]amino}-2-[2-propyl-4-(1H-pyrazol-4-yl)thiophen-3-yl]ethyl}pyrimidin-4(5H)-one | None | 137347947 | SHQGADSMADPNBQ-QFIPXVFZSA-N |
| Explore | None | 1BE | N-(6-chloro-3,3-dimethyl-3,4-dihydroisoquinolin-1-yl)-3-[2-propyl-4-(1H-pyrazol-4-yl)thiophen-3-yl]-L-alanine | None | 135566788;70789287 | GZLUSHWHRPZJDJ-FQEVSTJZSA-N |
| Explore | None | 1BF | N-(6-chloro-3,3-dimethyl-3,4-dihydroisoquinolin-1-yl)-3-[4-(1H-pyrazol-4-yl)thiophen-3-yl]-L-alanine | None | 135566784;70789280 | ASNJXTHXWLJRAC-SFHVURJKSA-N |
| Explore | None | 1BL | (2R)-5-{[(2S,3R)-4-{[1-(3-tert-butylphenyl)cyclohexyl]amino}-1-(3,5-difluorophenyl)-3-hydroxybutan-2-yl]amino}-2-hydroxy-5-oxopentanoic acid | None | 70789282 | ZQBAKJWCBZPMKW-OYUWMTPXSA-N |
| Explore | None | 1BS | 2-{(1S)-1-[(6-chloro-3,3-dimethyl-3,4-dihydroisoquinolin-1-yl)amino]-2-phenylethyl}pyrido[4,3-d]pyrimidin-4(1H)-one | CHEMBL2346800 | 135566787;70789285 | DQYKHJYAOKSEPD-QFIPXVFZSA-N |
| Explore | None | 1CH | N-(3,3-dimethyl-3,4-dihydroisoquinolin-1-yl)-L-phenylalanine | None | 135532136;6947362;824173 | SKZOZLFDNIMQMW-KRWDZBQOSA-N |
| Explore | None | 1H5 | N-{3-[(4S,5R)-2-amino-5-fluoro-4-(fluoromethyl)-5,6-dihydro-4H-1,3-oxazin-4-yl]-4-fluorophenyl}-5-cyanopyridine-2-carboxamide | CHEMBL2347186 | 66559017 | MMPPCMJOPZGPPA-MAUKXSAKSA-N |
| Explore | None | 1H6 | N-{3-[(4R,5S)-2-amino-5-fluoro-4-methyl-5,6-dihydro-4H-1,3-oxazin-4-yl]-4-fluorophenyl}-5-cyanopyridine-2-carboxamide | CHEMBL2347205 | 66558858 | ALKHFUPBQSAGMS-CRAIPNDOSA-N |
| Explore | None | 1H7 | N-{3-[(4R,5R)-2-amino-5-fluoro-4-methyl-5,6-dihydro-4H-1,3-oxazin-4-yl]-4-fluorophenyl}-5-cyanopyridine-2-carboxamide | CHEMBL2347204 | 66558601 | ALKHFUPBQSAGMS-MAUKXSAKSA-N |
| Explore | None | 1H8 | N-{3-[(4S)-2-amino-4-methyl-5,6-dihydro-4H-1,3-oxazin-4-yl]-4-fluorophenyl}-5-cyanopyridine-2-carboxamide | CHEMBL2347203 | 53241445 | ZTXUJRWOHXVUAT-SFHVURJKSA-N |
| Explore | None | 1HG | N-{3-[(4R,5R,6S)-2-amino-5-fluoro-4-methyl-6-(trifluoromethyl)-5,6-dihydro-4H-1,3-oxazin-4-yl]-4-fluorophenyl}-5-cyanopyridine-2-carboxamide | CHEMBL2347188 | 71305061 | UMHIFKHNODSZCU-RLFYNMQTSA-N |
| Explore | None | 1HH | N-{3-[(4R,5R,6R)-2-amino-5-fluoro-4-methyl-6-(trifluoromethyl)-5,6-dihydro-4H-1,3-oxazin-4-yl]-4-fluorophenyl}-5-cyanopyridine-2-carboxamide | CHEMBL2347189 | 71305060 | UMHIFKHNODSZCU-HDMKZQKVSA-N |
| Explore | None | 1HJ | N-{3-[(4S,6R)-2-amino-4-methyl-6-(trifluoromethyl)-5,6-dihydro-4H-1,3-oxazin-4-yl]-4-fluorophenyl}-5-cyanopyridine-2-carboxamide | CHEMBL2347207 | 71305059 | MELQHVBGGSKVJQ-QAPCUYQASA-N |
| Explore | None | 1HL | N-{3-[(4S,6S)-2-amino-4-methyl-6-(trifluoromethyl)-5,6-dihydro-4H-1,3-oxazin-4-yl]-4-fluorophenyl}-5-cyanopyridine-2-carboxamide | CHEMBL2347208 | 71305058 | MELQHVBGGSKVJQ-YJBOKZPZSA-N |
| Explore | None | 1HM | N-{3-[(4S,6S)-2-amino-4-(fluoromethyl)-6-(trifluoromethyl)-5,6-dihydro-4H-1,3-oxazin-4-yl]-4-fluorophenyl}-5-cyanopyridine-2-carboxamide | CHEMBL2347187 | 71305057 | QCMXWFUAVCHHIA-MAUKXSAKSA-N |
| Explore | None | 1HO | N-{3-[(4S)-2-amino-5,5-difluoro-4-(fluoromethyl)-5,6-dihydro-4H-1,3-oxazin-4-yl]-4-fluorophenyl}-5-cyanopyridine-2-carboxamide | CHEMBL2347190 | 71112644 | OIFTUNMTFHXWBX-QGZVFWFLSA-N |
| Explore | None | 1HQ | N-{3-[(4S)-2-amino-4-(difluoromethyl)-5,6-dihydro-4H-1,3-oxazin-4-yl]-4-fluorophenyl}-5-cyanopyridine-2-carboxamide | CHEMBL2347206 | 71112763 | ZQBDXEARYNLKKR-SFHVURJKSA-N |
| Explore | None | 1LI | N-[(1S,2R)-3-{[1-(3-tert-butylphenyl)cyclohexyl]amino}-1-(3,5-difluorobenzyl)-2-hydroxypropyl]acetamide | CHEMBL571860 | 11754571 | RJXIEHBFRZLGTH-IZZNHLLZSA-N |
| Explore | None | 1M4 | (4R)-2'-amino-6-bromo-1',2,2-trimethyl-2,3-dihydrospiro[chromene-4,4'-imidazol]-5'(1'H)-one | None | 137347967 | GCJNGEZDKLVQNN-CQSZACIVSA-N |
| Explore | None | 1M5 | (4R)-2'-amino-6-(3-chlorophenyl)-1',2,2-trimethyl-2,3-dihydrospiro[chromene-4,4'-imidazol]-5'(1'H)-one | None | 137347968 | MPQDZTDGJUCWQL-HXUWFJFHSA-N |
| Explore | None | 1M6 | 3-[(4R)-2'-amino-1',2,2-trimethyl-5'-oxo-1',2,3,5'-tetrahydrospiro[chromene-4,4'-imidazol]-6-yl]benzonitrile | None | 137347969 | LASIJFPKQNWUQE-OAQYLSRUSA-N |
| Explore | None | 1M7 | (4R)-2-amino-1,3',3'-trimethyl-7'-(pyrimidin-5-yl)-3',4'-dihydro-2'H-spiro[imidazole-4,1'-naphthalen]-5(1H)-one | CHEMBL2349470 | 66684136 | UPOMBIAVTOFWMY-LJQANCHMSA-N |
| Explore | None | 1QT | (3S)-3-[(1R)-2-{[(4S)-6-ethyl-3,4-dihydrospiro[chromene-2,1'-cyclobutan]-4-yl]amino}-1-hydroxyethyl]-4-azabicyclo[11.3.1]heptadeca-1(17),13,15-trien-5-one | CHEMBL2407345 | 71598542 | QPAQZVPVDCXNCF-YTCPBCGMSA-N |
| Explore | None | 1QU | 1-cyclopentyl-N-[(2S,3R)-3-hydroxy-1-phenyl-4-{[3-(trifluoromethyl)benzyl]amino}butan-2-yl]-6-oxo-5-(2-oxopyrrolidin-1-yl)-1,6-dihydropyridine-3-carboxamide | CHEMBL2407494 | 71598543 | QKLJNYJRYSKKKP-LMSSTIIKSA-N |
| Explore | None | 1R6 | (12S)-12-[(1R)-2-{[(4S)-6-ethyl-3,4-dihydrospiro[chromene-2,1'-cyclobutan]-4-yl]amino}-1-hydroxyethyl]-1,13-diazatricyclo[13.3.1.1~6,10~]icosa-6(20),7,9,15(19),16-pentaene-14,18-dione | CHEMBL2407488 | 71581445 | LCSGKLXXIKDHLA-OIFRRMEBSA-N |
| Explore | None | 1R8 | (3S)-3-[(1R)-2-{[(4S)-6-ethyl-3,4-dihydrospiro[chromene-2,1'-cyclobutan]-4-yl]amino}-1-hydroxyethyl]-4-azabicyclo[10.3.1]hexadeca-1(16),12,14-trien-5-one | CHEMBL2407344 | 71581444 | NUISAGYICVEVAE-HZFUHODCSA-N |
| Explore | None | 1SQ | ISOQUINOLIN-1-AMINE | CHEMBL62083 | 73742 | OSILBMSORKFRTB-UHFFFAOYSA-N |
| Explore | None | 1W0 | (3aS,7aR)-7a-[3-(pyrimidin-5-yl)phenyl]-3a,6,7,7a-tetrahydro-4H-pyrano[4,3-d][1,3]oxazol-2-amine | None | 72712537 | QBOAOWFKBWILHE-GDBMZVCRSA-N |
| Explore | None | 1W1 | 2-[(3aR,7aR)-2-amino-7a-(2,4-difluorophenyl)-3a,6,7,7a-tetrahydro[1,3]oxazolo[5,4-c]pyridin-5(4H)-yl]pyridine-3-carbonitrile | None | 137347998 | RDCJBIHDYIOWEV-CRAIPNDOSA-N |
| Explore | None | 1W2 | 2-[(3aS,7aR)-2-amino-3a-(2,4-difluorophenyl)-3a,6,7,7a-tetrahydro[1,3]oxazolo[4,5-c]pyridin-5(4H)-yl]pyridine-3-carbonitrile | None | 137347999 | UKQSZNNDBLMQNX-CRAIPNDOSA-N |
| Explore | None | 1WP | (3aR,7aR)-3a-[3-(5-chloropyridin-3-yl)phenyl]-3a,4,5,6,7,7a-hexahydro-1,3-benzoxazol-2-amine | None | 72712745 | NVRCQOQFKIFZLP-SJLPKXTDSA-N |
| Explore | None | 1YS | (1R,3S,4S,5R)-3-{4-amino-3-fluoro-5-[(1,1,1,3,3,3-hexafluoropropan-2-yl)oxy]benzyl}-5-[(3-tert-butylbenzyl)amino]tetrahydro-2H-thiopyran-4-ol 1-oxide | CHEMBL2425608 | 71664591 | SVZBUJIOBQPGEC-UDLQCLCKSA-N |
| Explore | None | 1YT | (1R,3S,4S,5R)-3-(4-amino-3-fluoro-5-{[(2R)-1,1,1-trifluoro-3-methoxypropan-2-yl]oxy}benzyl)-5-[(3-tert-butylbenzyl)amino]tetrahydro-2H-thiopyran-4-ol 1-oxide | CHEMBL2425612 | 51003469 | FIUDDEQHPBHZBI-XPLIUGCLSA-N |
| Explore | None | 1YU | (1S,3S,4S,5R)-3-{4-amino-3-fluoro-5-[(1,1,1,3,3,3-hexafluoropropan-2-yl)oxy]benzyl}-5-[(3-tert-butylbenzyl)amino]tetrahydro-2H-thiopyran-4-ol 1-oxide | CHEMBL2425609 | 71664592 | SVZBUJIOBQPGEC-DAMLKHMOSA-N |
| Explore | None | 23I | N-[(1S,2S,4R)-2-HYDROXY-1-ISOBUTYL-5-({(1S)-1-[(ISOPROPYLAMINO)CARBONYL]-2-METHYLPROPYL}AMINO)-4-METHYL-5-OXOPENTYL]-5-[METHYL(METHYLSULFONYL)AMINO]-N'-[(1R)-1-PHENYLETHYL]ISOPHTHALAMIDE | CHEMBL387771 | 16659106 | BJOCXJJVELLFKM-LLWRDSBASA-N |
| Explore | None | 2AQ | QUINOLIN-2-AMINE | CHEMBL61236 | 11379 | GCMNJUJAKQGROZ-UHFFFAOYSA-N |
| Explore | None | 2EX | (4R,4a'S,10a'S)-2-amino-8'-(2-fluoropyridin-3-yl)-1-methyl-3',4',4a',10a'-tetrahydro-1'H-spiro[imidazole-4,10'-pyrano[4,3-b]chromen]-5(1H)-one | CHEMBL3127106 | 56947421 | DWEUDIDNAOSEBW-UVFQYZLESA-N |
| Explore | None | 2FB | (6R)-6-(4-methoxyphenyl)-2-methyl-6-(3-pyrimidin-5-ylphenyl)pyrrolo[3,4-d][1,3]thiazol-4-amine | None | 137348044 | YQFNSFOVYAQJAF-HSZRJFAPSA-N |
| Explore | None | 2LI | N-[(1S,2R)-3-{[(5S)-5-(3-tert-butylphenyl)-4,5,6,7-tetrahydro-1H-indazol-5-yl]amino}-1-(3,5-difluorobenzyl)-2-hydroxypropyl]acetamide | None | 44537810 | BAILJXDQIBWAPX-GKRYNVPLSA-N |
| Explore | None | 2X4 | (4R,4a'S,10a'S)-7'-(5-chloropyridin-3-yl)-3',4',4a',10a'-tetrahydro-1'H-spiro[1,3-oxazole-4,5'-pyrano[3,4-b]chromen]-2-amine | CHEMBL3265330 | 67950044 | BGRWOLNAPSRJIS-LSBZLQRGSA-N |
| Explore | None | 2X5 | (4R,4a'R,10a'R)-7'-(5-chloropyridin-3-yl)-3',4',4a',10a'-tetrahydro-1'H-spiro[1,3-oxazole-4,5'-pyrano[3,4-b]chromen]-2-amine | CHEMBL3265335 | 67950241 | BGRWOLNAPSRJIS-UCLAIMLFSA-N |
| Explore | None | 310 | N-carbamimidoyl-2-[2-(2-chlorophenyl)-5-[4-(4-ethanoylphenoxy)phenyl]pyrrol-1-yl]ethanamide | CHEMBL253237 | 11583947;137348113 | MIEKBLPHNQZVQQ-UHFFFAOYSA-N |
| Explore | None | 314 | N'-[(1S,2R)-2-[(2R,4S)-4-benzylpiperidin-2-yl]-1-(3,5-difluorobenzyl)-2-hydroxyethyl]-5-methyl-N,N-dipropylbenzene-1,3-dicarboxamide | CHEMBL255194 | 24808496 | UKXYKYZOSFWZIM-FLQGXGFZSA-N |
| Explore | None | 316 | N'-[(1S,2S)-2-[(2S)-4-benzyl-3-oxopiperazin-2-yl]-1-(3,5-difluorobenzyl)-2-hydroxyethyl]-5-methyl-N,N-dipropylbenzene-1,3-dicarboxamide | CHEMBL509210 | 24808497 | XKXGRRZAMDHVGR-CPCREDONSA-N |
| Explore | None | 318 | N'-[(1S,2S)-2-[(4S)-1-benzyl-5-oxoimidazolidin-4-yl]-1-(3,5-difluorobenzyl)-2-hydroxyethyl]-5-methyl-N,N-dipropylbenzene-1,3-dicarboxamide | CHEMBL507651 | 11520033 | HZWNNIVRFLRAQW-CHQNGUEUSA-N |
| Explore | None | 32P | 3-{2-[(5-AMINOPENTYL)AMINO]-2-OXOETHOXY}-5-({[1-(4-FLUOROPHENYL)ETHYL]AMINO}CARBONYL)PHENYL PHENYLMETHANESULFONATE | CHEMBL426717 | 448772 | UUMRCVIXZFKZAU-OAQYLSRUSA-N |
| Explore | None | 3BN | 3-BENZOYL-N-[(1S,2R)-1-BENZYL-3-(CYCLOPROPYLAMINO)-2-HYDROXYPROPYL]-5-[METHYL(METHYLSULFONYL)AMINO]BENZAMIDE | CHEMBL202602 | 5327063 | WCVRLSCSQDAERN-RRPNLBNLSA-N |
| Explore | None | 3HF | N~3~-{(1S,2R)-1-benzyl-2-hydroxy-3-[(3-methoxybenzyl)amino]propyl}-N~1~,N~1~-dibutyl-1H-indole-1,3-dicarboxamide | None | 51000417 | JPMPCSZOVMUPRZ-UZNNEEJFSA-N |
| Explore | None | 3HH | N~1~-butyl-5-cyano-N~3~-{(1S,2R)-1-(3,5-difluorobenzyl)-2-hydroxy-3-[(3-methoxybenzyl)amino]propyl}-N~1~-methyl-1H-indole-1,3-dicarboxamide | None | 51000418 | ZAVRTXWWDAGODB-XDFJSJKPSA-N |
| Explore | None | 3J9 | (4R,4a'S,10a'R)-8'-(2-fluoropyridin-3-yl)-4a'-methyl-3',4',4a',10a'-tetrahydro-2'H-spiro[1,3-oxazole-4,10'-pyrano[3,2-b]chromen]-2-amine | CHEMBL3357661 | 67950186 | DMNHLGOPJBTFQJ-IHPCNDPISA-N |
| Explore | None | 3KO | (2E,5R)-5-(2-cyclohexylethyl)-5-{[(3R)-1-(cyclopentylacetyl)pyrrolidin-3-yl]methyl}-2-imino-3-methylimidazolidin-4-one | CHEMBL3354247 | 118720056 | ZROUWOKUKKGJPH-HYBUGGRVSA-N |
| Explore | None | 3KT | (2E,5R)-5-(2-cyclohexylethyl)-5-{[(1S,3R)-3-(cyclopentylamino)cyclohexyl]methyl}-2-imino-3-methylimidazolidin-4-one | CHEMBL3354250 | 57844200 | NOZCXTAZEGFFAQ-XZDHIHRUSA-N |
| Explore | None | 3KU | N-[(1R,3S)-3-{[(2E,4R)-4-(2-cyclohexylethyl)-2-imino-1-methyl-5-oxoimidazolidin-4-yl]methyl}cyclohexyl]pyridine-4-carboxamide | CHEMBL3354253 | 11582999 | NAGJGYNUXJYJOV-PIBDYAPNSA-N |
| Explore | None | 3KW | (2E,5R)-5-(2-cyclohexylethyl)-2-imino-3-methyl-5-{[(1S,3R)-3-(quinolin-2-ylamino)cyclohexyl]methyl}imidazolidin-4-one | None | 11568842 | XBQKWFZOPAEITA-TWLCBMPQSA-N |
| Explore | None | 3LL | (5S)-7-(2-fluoropyridin-3-yl)-3-[(3-methyloxetan-3-yl)ethynyl]spiro[chromeno[2,3-b]pyridine-5,4'-[1,3]oxazol]-2'-amine | CHEMBL3359763 | 45254510 | GKKFBOARESVMBW-VWLOTQADSA-N |
| Explore | None | 3LN | (4S)-2'-(2,2-dimethylpropoxy)-7'-(pyrimidin-5-yl)spiro[1,3-oxazole-4,9'-xanthen]-2-amine | CHEMBL3354688 | 45256109 | CHZHWZAKWGFQNL-DEOSSOPVSA-N |
| Explore | None | 3LO | (4S)-2'-(3,6-dihydro-2H-pyran-4-yl)-4'-fluoro-7'-(2-fluoropyridin-3-yl)spiro[1,3-oxazole-4,9'-xanthen]-2-amine | CHEMBL3354718 | 45254900 | UBJVRJGPVXTXQB-VWLOTQADSA-N |
| Explore | None | 3MR | (4S)-4-(2-AMINO-6-PHENOXYQUINAZOLIN-3(4H)-YL)-N,4-DICYCLOHEXYL-N-METHYLBUTANAMIDE | CHEMBL244347 | 16741239 | JKQCQYBXDQPJNC-LJAQVGFWSA-N |
| Explore | None | 3P5 | (3S,4S,5R)-3-(3-bromo-4-hydroxybenzyl)-5-[(3-cyclopropylbenzyl)amino]tetrahydro-2H-thiopyran-4-ol 1,1-dioxide | CHEMBL1614769 | 24877631 | NDEIDRFQAYLHLT-CBQOVEMMSA-N |
| Explore | None | 3RS | (2R)-3-[2-amino-6-(2-methylphenyl)quinolin-3-yl]-N-[(4R)-2,2-dimethyltetrahydro-2H-pyran-4-yl]-2-methylpropanamide | CHEMBL1821728 | 53346491 | QMSHBBGXSXAGOO-XMSQKQJNSA-N |
| Explore | None | 3RU | 3-(2-aminoquinolin-3-yl)-N-(cyclohexylmethyl)propanamide | CHEMBL1821813 | 53346495 | YOUIXYWUUXULRM-UHFFFAOYSA-N |
| Explore | None | 3TO | 3-[2-(3-{[(furan-2-ylmethyl)(methyl)amino]methyl}phenyl)ethyl]pyridin-2-amine | CHEMBL569654 | 44552610 | PGBSGPMEMSPFFE-UHFFFAOYSA-N |
| Explore | None | 3UT | (5S)-3-(5,6-dihydro-2H-pyran-3-yl)-1-fluoro-7-(2-fluoropyridin-3-yl)spiro[chromeno[2,3-c]pyridine-5,4'-[1,3]oxazol]-2'-amine | CHEMBL4564735 | 53465141 | JAZOCUNZCUBRJX-DEOSSOPVSA-N |
| Explore | None | 3UW | (4S,4a'S,10a'R)-2-amino-8'-(2-fluoropyridin-3-yl)-1-methyl-3',4',4a',10a'-tetrahydro-2'H-spiro[imidazole-4,10'-pyrano[3,2-b]chromen]-5(1H)-one | CHEMBL3357656 | 56948072 | GZRDWAATBYKNGI-FTRWYGJKSA-N |
| Explore | None | 3UX | (4S,4a'R,10a'S)-2-amino-8'-(2-fluoropyridin-3-yl)-1,4a'-dimethyl-3',4',4a',10a'-tetrahydro-2'H-spiro[imidazole-4,10'-pyrano[3,2-b]chromen]-5(1H)-one | CHEMBL3357659 | 56947698 | RYCBSDWTFORSET-UIFIKXQLSA-N |
| Explore | None | 3UY | (4R,4a'R,10a'S)-8'-(2-fluoropyridin-3-yl)-4a'-methyl-3',4',4a',10a'-tetrahydro-2'H-spiro[1,3-oxazole-4,10'-pyrano[3,2-b]chromen]-2-amine | CHEMBL3357662 | 67971215 | DMNHLGOPJBTFQJ-RLLQIKCJSA-N |
| Explore | None | 3VO | (4aR,8aS)-8a-(2,4-difluorophenyl)-4,4a,5,6,8,8a-hexahydropyrano[3,4-d][1,3]thiazin-2-amine | CHEMBL3414706 | 71268850 | CUNQNADGWRXYCV-SDBXPKJASA-N |
| Explore | None | 3VP | (4aR,6R,8aS)-8a-(2,4-difluorophenyl)-6-(fluoromethyl)-4,4a,5,6,8,8a-hexahydropyrano[3,4-d][1,3]thiazin-2-amine | CHEMBL3414701 | n/a | HUZWRILIHNBINL-HNXYLICVSA-N |
| Explore | None | 3WP | (4S)-4-(2,4-difluorophenyl)-4-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine | CHEMBL3414702 | 90657111 | JRYNZJXSUKTLGF-NSHDSACASA-N |
| Explore | None | 411 | 3-bromo-N-[4-[1-(2-carbamimidamido-2-oxo-ethyl)-5-phenyl-pyrrol-2-yl]phenyl]benzamide | CHEMBL252189 | 11606008;137629066 | XWWAMKGNSKOVNS-UHFFFAOYSA-N |
| Explore | None | 43K | (5S)-7-(2-fluoropyridin-3-yl)-3-(2-fluoropyridin-4-yl)spiro[chromeno[2,3-c]pyridine-5,4'-[1,3]oxazol]-2'-amine | CHEMBL3394057 | 58466119 | LEFDLEYZSDTVMO-DEOSSOPVSA-N |
| Explore | None | 454 | 8,8-diphenyl-2,3,4,8-tetrahydroimidazo[1,5-a]pyrimidin-6-amine | CHEMBL582044 | 11543843 | UFWSJOVQEPTPNE-UHFFFAOYSA-N |
| Explore | None | 472 | (5S)-2-amino-3-methyl-5-pyridin-4-yl-5-(3-pyridin-3-ylphenyl)-3,5-dihydro-4H-imidazol-4-one | None | 49866505 | AIKOTXHNUIYVMD-HXUWFJFHSA-N |
| Explore | None | 4QA | 4-(cyclohexylamino)-1-(3-fluorophenyl)-8-[3-(propan-2-yloxy)benzyl]-1,3,8-triazaspiro[4.5]dec-3-en-2-one | None | 136021259;58949967 | KZMSAJWZLCSCQP-UHFFFAOYSA-N |
| Explore | None | 4QD | 8-(3-{[(2S)-1-aminopropan-2-yl]oxy}benzyl)-4-(cyclohexylamino)-1-(3-fluorophenyl)-1,3,8-triazaspiro[4.5]dec-3-en-2-one | None | 136375305;66738014 | GJCCGBZILLQLCV-NRFANRHFSA-N |
| Explore | None | 4QF | (5R,7S)-8-benzyl-4-(cyclohexylamino)-1-(3-fluorophenyl)-7-methyl-1,3,8-triazaspiro[4.5]dec-3-en-2-one | None | 136652638;91267056 | YNODVOARUZZRMG-CCLHPLFOSA-N |
| Explore | None | 4RW | (4aS,8aR)-4a,5,6,7,8,8a-hexahydro-4H-3,1-benzothiazin-2-amine | None | 91799648 | SZAFVQHJBWFBIQ-RNFRBKRXSA-N |
| Explore | None | 4RX | N-[(4S,4aS,6S,8aR)-10-aminohexahydro-3H-4,8a-(epithiomethenoazeno)isochromen-6(1H)-yl]-3-chlorobenzamide | CHEMBL3586136 | 71714118 | SLYXQQNGVHPIRQ-CFAJVAMVSA-N |
| Explore | None | 4RY | N-[(4aS,6S,8aR)-2-amino-5,6,7,8-tetrahydro-4a,8a-(methanooxymethano)-3,1-benzothiazin-6(4H)-yl]-3-chlorobenzamide | None | 91799650 | XDMHBNONUZHFDP-JQFCIGGWSA-N |
| Explore | None | 4RZ | N-[(4aS,6S,8aR)-2-amino-4a,5,6,7,8,8a-hexahydro-4H-3,1-benzothiazin-6-yl]-3-chlorobenzamide | None | 91799649 | TUSBLKXHGGIFCU-KGYLQXTDSA-N |
| Explore | None | 508 | (1R,4'S)-3,4-dihydro-2H-spiro[naphthalene-1,3'-pyrrolidin]-4'-yl[(2S,4R)-2,4-diphenylpiperidin-1-yl]methanone | CHEMBL1934292 | 54765328 | MXPUWFOJTXJTTA-RNWXARPHSA-N |
| Explore | None | 52K | N-{3-[(3R)-5-amino-3-methyl-3,6-dihydro-2H-1,4-oxazin-3-yl]phenyl}-5-chloropyridine-2-carboxamide | CHEMBL3634122 | 50991585 | ZZUPAAPYPBQGKS-KRWDZBQOSA-N |
| Explore | None | 532 | (5S)-2-amino-3-methyl-5-[3-(pyridin-3-yl)phenyl]-5-(thiophen-3-yl)-3,5-dihydro-4H-imidazol-4-one | None | 137348308 | AOGBXAFIKRFUPJ-IBGZPJMESA-N |
| Explore | None | 54M | (5R)-5-(4-methoxyphenyl)-5-(3-pyrimidin-5-ylphenyl)-3,4-dihydropyrrol-2-amine | None | 137348310 | MLDNPVIFXVSEGX-OAQYLSRUSA-N |
| Explore | None | 569 | (5R)-2-amino-5-(4-fluoro-3-pyrimidin-5-ylphenyl)-3-methyl-5-[4-(trifluoromethoxy)phenyl]-3,5-dihydro-4H-imidazol-4-one | CHEMBL568115 | 11539562 | RNJTYVPMRSKRKE-HXUWFJFHSA-N |
| Explore | None | 586 | N-[4-(1-BENZYLCARBAMOYL-2-METHYL-PROPYLCARBAMOYL)-1-(3,5-DIFLUORO-PHENOXYMETHYL)-2-HYDROXY-4-METHOXY-BUTYL]-5-(METHANES ULFONYL-METHYL-AMINO)-N'-(1-PHENYLETHYL)-ISOPHTHALAMIDE | CHEMBL573106 | 44631838 | IEIHXPJWOSDLBU-VWMOWEEZSA-N |
| Explore | None | 591 | (5S)-2-amino-5-(1-ethyl-1H-pyrazol-4-yl)-3-methyl-5-[3-(pyrimidin-5-yl)phenyl]-3,5-dihydro-4H-imidazol-4-one | None | 137348324 | DNDFMOOQRXKYQL-IBGZPJMESA-N |
| Explore | None | 593 | (5S)-2-amino-3-methyl-5-phenyl-5-[(3S,5S,7S)-tricyclo[3.3.1.1~3,7~]dec-1-yl]-3,5-dihydro-4H-imidazol-4-one | None | n/a | BEDDENNXVBITIQ-WYIOCLOVSA-N |
| Explore | None | 5E7 | N-[(2S,3R)-3-hydroxy-4-({(2S,3S)-3-hydroxy-1-[(2-methylpropyl)amino]-1-oxobutan-2-yl}amino)-1-phenylbutan-2-yl]-5-[methyl(methylsulfonyl)amino]-N'-[(1R)-1-phenylethyl]benzene-1,3-dicarboxamide | None | 89836206 | ZIEVAMMZKBNDFB-AAZBAGLXSA-N |
| Explore | None | 5HA | N-[(1S,2R)-1-BENZYL-3-(CYCLOPROPYLAMINO)-2-HYDROXYPROPYL]-5-[METHYL(METHYLSULFONYL)AMINO]-N'-[(1R)-1-PHENYLETHYL]ISOPHTHALAMIDE | CHEMBL378225 | 5287532 | VPNIQGRFZCTBEZ-SPTGULJVSA-N |
| Explore | None | 5QU | (2~{R},4~{S},6~{S})-4-[2,4-bis(fluoranyl)-5-pyrimidin-5-yl-phenyl]-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1,3-thiazinan-2-amine | None | 137348392 | QXXCXVMLHLDXDN-JENIJYKNSA-N |
| Explore | None | 5QV | (4~{S},6~{S})-4-[2,4-bis(fluoranyl)-5-pyrimidin-5-yl-phenyl]-6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-methyl-5,6-dihydro-1,3-thiazin-2-amine | CHEMBL3427251 | 90253366 | UWUREBMKVJWTPP-PXNSSMCTSA-N |
| Explore | None | 5T5 | [(1~{R},2~{R})-2-[(4~{S})-2-azanyl-4-[4-[bis(fluoranyl)methoxy]phenyl]-5~{H}-1,3-oxazol-4-yl]cyclopropyl]-(5-chloranylpyridin-3-yl)methanone | None | 137348398 | AVRZQFKBYKMVDH-SPYBWZPUSA-N |
| Explore | None | 5T6 | (4~{S})-4-[4-[bis(fluoranyl)methoxy]-3-methyl-phenyl]-4-[3-(5-chloranylpyridin-3-yl)phenyl]-5~{H}-1,3-oxazol-2-amine | None | 44178082 | UQLVXWKMSVKVGL-QFIPXVFZSA-N |
| Explore | None | 5T7 | (1~{R},2~{R})-2-[(4~{R})-2-azanyl-5,5-bis(fluoranyl)-4-methyl-6~{H}-1,3-oxazin-4-yl]-~{N}-(3-chloranylquinolin-8-yl)cyclopropane-1-carboxamide | None | 71009238 | FPQSTKSVKJAHKE-PSTGCABASA-N |
| Explore | None | 5T8 | (5~{R})-5-[3-[(3-chloranylquinolin-8-yl)amino]phenyl]-5-methyl-2,6-dihydro-1,4-oxazin-3-amine | None | 118703101 | MISZEAYFRRVHET-FQEVSTJZSA-N |
| Explore | None | 60S | 5-{(2E,4aR,7aR)-6-[5-fluoro-4-methyl-6-(methylamino)pyrimidin-2-yl]-2-imino-3-methyl-4-oxooctahydro-7aH-pyrrolo[3,4-d]pyrimidin-7a-yl}thiophene-2-carbonitrile | CHEMBL3799879 | 118796840 | ZGUINBOSNMEMBB-VOJFVSQTSA-N |
| Explore | None | 60T | (2E,4aR,7aS)-7a-(2,6-difluorophenyl)-6-(5-fluoro-4-methoxy-6-methylpyrimidin-2-yl)-2-imino-3-methyloctahydro-4H-pyrrolo[3,4-d]pyrimidin-4-one | CHEMBL3640258 | 44467506 | NAXGDHGFSCZYGN-OVWNDWIMSA-N |
| Explore | None | 60U | 5-[(2E,4aR,7aR)-6-(4-ethoxy-5-fluoro-6-methylpyrimidin-2-yl)-2-imino-3-methyl-4-oxooctahydro-7aH-pyrrolo[3,4-d]pyrimidin-7a-yl]thiophene-2-carbonitrile | CHEMBL3799339 | 44479524 | NAIWJSDALLQSJO-BUXKBTBVSA-N |
| Explore | None | 60V | 5-[(2E,4aR,7aR)-6-(5-fluoro-4-methoxy-6-methylpyrimidin-2-yl)-2-imino-3-methyl-4-oxooctahydro-7aH-pyrrolo[3,4-d]pyrimidin-7a-yl]thiophene-2-carbonitrile | CHEMBL3798544 | 44247586 | ZPAVWCJTQRQRQL-VOJFVSQTSA-N |
| Explore | None | 60W | 3-{5-[(2E,4aR,7aR)-6-(5-fluoro-4-methoxypyrimidin-2-yl)-2-imino-3-methyl-4-oxooctahydro-7aH-pyrrolo[3,4-d]pyrimidin-7a-yl]thiophen-3-yl}benzonitrile | CHEMBL3800286 | 71492530 | UKGROMSNWKWCLS-HJPURHCSSA-N |
| Explore | None | 60X | (2E,4aR,7aS)-7a-(2,4-difluorophenyl)-6-(5-fluoro-4-methoxy-6-methylpyrimidin-2-yl)-2-imino-3-methyloctahydro-4H-pyrrolo[3,4-d]pyrimidin-4-one | CHEMBL3640290 | 44467360 | FNMJFZYRSQTKIH-HXPMCKFVSA-N |
| Explore | None | 60Y | 3-{5-[(2E,4aR,7aR)-6-(5-fluoropyrimidin-2-yl)-2-imino-3-methyl-4-oxooctahydro-7aH-pyrrolo[3,4-d]pyrimidin-7a-yl]thiophen-3-yl}benzonitrile | CHEMBL2178718 | 71457203 | PTLJUNIICOHEHE-JTSKRJEESA-N |
| Explore | None | 625 | 4-(4-{1-[(6-aminopyridin-2-yl)methyl]-5-(2-chlorophenyl)-1H-pyrrol-2-yl}phenoxy)butanenitrile | CHEMBL1089137 | 11719190 | CERJQPWNRISSQS-UHFFFAOYSA-N |
| Explore | None | 66H | N-{3-[(2E,4R)-2-imino-1-methyl-5-oxo-4-phenylimidazolidin-4-yl]phenyl}furan-2-carboxamide | None | 137348435 | SOHROZVXKZYZIE-OAQYLSRUSA-N |
| Explore | None | 66J | (3E,5S)-5-{3-chloro-5-[5-(prop-1-yn-1-yl)pyridin-3-yl]thiophen-2-yl}-2,5-dimethyl-1,2,4-thiadiazinan-3-imine 1,1-dioxide | CHEMBL3259832 | 68111516 | VKVMIZCLMUKTTA-KRWDZBQOSA-N |
| Explore | None | 68J | N-(1-{3-[2-(2-amino-3-{3-[(3,3-dimethylbutyl)amino]-3-oxopropyl}quinolin-6-yl)phenyl]prop-2-yn-1-yl}cyclopropyl)-4-fluorobenzamide | CHEMBL3808441 | 118797904 | QLQWEADMFLXRFH-UHFFFAOYSA-N |
| Explore | None | 68K | N-(6-{2-[2-(2-amino-3-{3-[(3,3-dimethylbutyl)amino]-3-oxopropyl}quinolin-6-yl)phenyl]ethyl}pyridin-3-yl)-4-fluorobenzamide | CHEMBL3809870 | 118797905 | RTOUKFMBOVMEOT-UHFFFAOYSA-N |
| Explore | None | 68L | N-[(5S)-2'-amino-3-(5,6-dihydro-2H-pyran-3-yl)-5'H-spiro[1-benzopyrano[2,3-c]pyridine-5,4'-[1,3]oxazol]-7-yl]-5-chloropyridine-2-carboxamide | CHEMBL4294221 | 137348437 | ZXMNKHTXDORUCR-VWLOTQADSA-N |
| Explore | None | 68M | (2R)-3-[2-amino-6-(3-methylpyridin-2-yl)quinolin-3-yl]-N-(3,3-dimethylbutyl)-2-methylpropanamide | CHEMBL1821826 | 53465991 | ZVOWIRUWKAUSAB-QGZVFWFLSA-N |
| Explore | None | 6BS | 3-[2-amino-6-(2-methylphenyl)quinolin-3-yl]-N-(3,3-dimethylbutyl)propanamide | CHEMBL3808672 | 53236891 | XKCSLMBNFSFIEK-UHFFFAOYSA-N |
| Explore | None | 6T6 | (2R)-2-methyl-5-phenyl-2-(3-pyridin-3-ylphenyl)-2,3-dihydro-1H-imidazol-4-amine | None | 60202319 | BLSGQDNQCUBPGO-OAQYLSRUSA-N |
| Explore | None | 6T9 | 5-Ethoxy-pyridine-2-carboxylic acid [3-((R)-2-amino-5,5-difluoro-4-methyl-5,6-dihydro-4H-[1,3]oxazin-4-yl)-4-fluoro-phenyl]-amide | CHEMBL2347367 | 71305034 | DWKGLYKXNUIYDM-GOSISDBHSA-N |
| Explore | None | 6TG | (2S)-2-(4-methoxy-3,5-dimethylphenyl)-5-methyl-2-(3-pyrimidin-5-ylphenyl)-2H-imidazol-4-amine | CHEMBL2180030 | 49836033 | PZSMDBYYYKPYFV-QHCPKHFHSA-N |
| Explore | None | 6WD | (4~{S},6~{S})-4-[2,4-bis(fluoranyl)phenyl]-4-methyl-6-pyrimidin-5-yl-5,6-dihydro-1,3-thiazin-2-amine | CHEMBL4444341 | 90253396 | AHFBBIPUKVCJEP-ZFWWWQNUSA-N |
| Explore | None | 6WE | (4~{S},6~{S})-4-[2,4-bis(fluoranyl)phenyl]-6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-methyl-5,6-dihydro-1,3-thiazin-2-amine | CHEMBL4551234 | 90253397 | XCTPNVXKKHOANI-BBRMVZONSA-N |
| Explore | None | 6Z0 | N-[3-[(4R)-2-azanylidene-5,5-bis(fluoranyl)-4-methyl-1,3-oxazinan-4-yl]-4-fluoranyl-phenyl]-5-cyano-pyridine-2-carboxamide | CHEMBL2347215 | 53241828 | DVMUZHLUMHPCGZ-QGZVFWFLSA-N |
| Explore | None | 712 | 3-({[(1R)-1-(4-FLUOROPHENYL)ETHYL]AMINO}CARBONYL)-5-[METHYL(METHYLSULFONYL)AMINO]BENZYL ALPHA-METHYL-D-PHENYLALANINATE | CHEMBL218451 | 16094313 | PTQRJCCBUDSHTQ-WHLCRQNOSA-N |
| Explore | None | 74A | N'-{(1S,2S)-1-(3,5-difluorobenzyl)-2-hydroxy-2-[(2R)-4-(phenylcarbonyl)piperazin-2-yl]ethyl}-5-methyl-N,N-dipropylbenzene-1,3-dicarboxamide | CHEMBL1097318 | 45105269 | ZJLWDMHHAMNWRK-QAXCHELISA-N |
| Explore | None | 74B | (4aR,6R,8aS)-8a-(2,4-difluoro-5-{[(2,2,2-trifluoroethyl)amino]methyl}phenyl)-6-(fluoromethyl)-4,4a,5,6,8,8a-hexahydropyrano[3,4-d][1,3]thiazin-2-amine | CHEMBL3673194 | 86762648 | KXRWMDHPUURSND-USBNGQNGSA-N |
| Explore | None | 757 | 5-[[(2S)-2-[[(3R,4S)-5-(3,5-difluorophenoxy)-3-hydroxy-4-[[3-(methyl-methylsulfonyl-amino)-5-[[(1R)-1-phenylethyl]carbamoyl]phenyl]carbonylamino]pentanoyl]amino]-3-methyl-butanoyl]amino]benzene-1,3-dicarboxylic acid | None | 49866564 | XYKCBRCSBVZGIL-WRXYKUNKSA-N |
| Explore | None | 779 | 1-[(1R,3S)-3-{[(2E,4R)-4-(2-cyclohexylethyl)-2-imino-1-methyl-5-oxoimidazolidin-4-yl]methyl}cyclohexyl]-3-phenylurea | CHEMBL3354255 | 57844259 | CVMRAJSOLFSMNH-UNIVCBNLSA-N |
| Explore | None | 7F3 | (1S)-4-fluoro-1-(4-fluoro-3-pyrimidin-5-ylphenyl)-1-[2-(trifluoromethyl)pyridin-4-yl]-1H-isoindol-3-amine | CHEMBL2177909 | 46206292 | UDQUVXUVXUGJFO-QHCPKHFHSA-N |
| Explore | None | 7H3 | N-{3-[(4aR,7aR)-2-amino-4,4a,5,6-tetrahydro-7aH-furo[2,3-d][1,3]thiazin-7a-yl]-4-fluorophenyl}-5-bromopyridine-2-carboxamide | CHEMBL3919597 | 89576898 | DACRJCISVSMZQT-XTZNXHDOSA-N |
| Explore | None | 842 | N-[(1S,2R)-1-(3,5-difluorobenzyl)-2-hydroxy-3-({1-[3-(1H-pyrazol-1-yl)phenyl]cyclohexyl}amino)propyl]acetamide | CHEMBL572081 | 45486979 | QXNFPOMRKODYSK-IZZNHLLZSA-N |
| Explore | None | 879 | 6-({2-(2-chlorophenyl)-5-[4-(pyrimidin-5-yloxy)phenyl]-1H-pyrrol-1-yl}methyl)pyridin-2-amine | CHEMBL1091999 | 11561538 | MNZJYJDKCYJKMU-UHFFFAOYSA-N |
| Explore | None | 8QV | (5S)-3-(3,6-dihydro-2H-pyran-4-yl)-7-[5-(prop-1-yn-1-yl)pyridin-3-yl]-5'H-spiro[1-benzopyrano[2,3-c]pyridine-5,4'-[1,3]oxazol]-2'-amine | CHEMBL4284110 | 137348743 | PAMPHNBKOPBUKU-MHZLTWQESA-N |
| Explore | None | 8T3 | N-[3-[(1S,3S,6S)-5-azanyl-3-methyl-4-azabicyclo[4.1.0]hept-4-en-3-yl]-4-fluoranyl-phenyl]-5-chloranyl-pyridine-2-carbox amide | CHEMBL2403773 | 71571523 | MELPDVINWCDKRF-JXBWDGJFSA-N |
| Explore | None | 8W4 | N-{(1S,2S)-1-[(2S)-4-benzyl-3-oxopiperazin-2-yl]-1-hydroxy-3-phenylpropan-2-yl}-7-ethyl-1,3,3-trimethyl-2,2-dioxo-1,2,3,4-tetrahydro-2lambda~6~-[1,2,5]thiadiazepino[3,4,5-hi]indole-9-carboxamide | CHEMBL4065655 | 126961340 | WBWSVNAKBNLSOJ-WXWREJFYSA-N |
| Explore | None | 916 | N-[(2S,3R)-4-{[(4S)-6-(2,2-dimethylpropyl)-2,2-dimethyl-3,4-dihydro-2H-thieno[2,3-b]pyran-4-yl]amino}-3-hydroxy-1-phenylbutan-2-yl]acetamide | None | 72200932 | YLIBYDKWVPKMKX-RJGXRXQPSA-N |
| Explore | None | 929 | N-[(2S,3S,5R)-1-[(3,5-difluorophenyl)methoxy]-3-hydroxy-5-methyl-6-[[(2S)-3-methyl-1-oxo-1-(phenylmethylamino)butan-2-yl]amino]-6-oxo-hexan-2-yl]-5-(methyl-methylsulfonyl-amino)-N'-[(1R)-1-phenylethyl]benzene-1,3-dicarboxamide | CHEMBL1076902 | 45277565 | SQCCLROLILAOBD-MLLWAOEYSA-N |
| Explore | None | 954 | 5-{(2E,4aR,7aR)-6-[5-fluoro-4-methyl-6-(methylsulfanyl)pyrimidin-2-yl]-2-imino-3-methyl-4-oxooctahydro-7aH-pyrrolo[3,4-d]pyrimidin-7a-yl}thiophene-2-carbonitrile | CHEMBL3797680 | 118796839 | RVOBSBJZKQOYEK-VOJFVSQTSA-N |
| Explore | None | 957 | N-[(1S,2R)-1-(3,5-difluorobenzyl)-3-({1-[4-(2,2-dimethylpropyl)thiophen-2-yl]cyclopropyl}amino)-2-hydroxypropyl]acetamide | CHEMBL1230648 | 46891887 | YEGCCSKZPHGALE-LEWJYISDSA-N |
| Explore | None | 996 | N-[(2S,3R)-4-{[(4S)-2-(2,2-dimethylpropyl)-6,6-dimethyl-4,5,6,7-tetrahydro-2H-indazol-4-yl]amino}-3-hydroxy-1-phenylbutan-2-yl]acetamide | None | 71608661 | RUVGZLLBYDXKFE-WPFOTENUSA-N |
| Explore | None | AA9 | N-((1S,2R)-3-(((1S)-2-(CYCLOHEXYLAMINO)-1--METHYL-2-OXOETHYL)AMINO)-2-HYDROXY-1-(PHENYLMETHYL)PROPYL)-3-(ETHYLAMINO)-5-((METHYLSULFONYL)(PHENYL)AMINO)BENZAMIDE | CHEMBL1210359 | 9939419 | SMMANAWVXZZNER-DZMJNENTSA-N |
| Explore | None | AEG | 4-[(2R)-2-aminopropyl]phenol | CHEMBL1230845 | 12234986 | GIKNHHRFLCDOEU-SSDOTTSWSA-N |
| Explore | None | AFJ | (2R,4S,5S)-N-butyl-4-hydroxy-2,7-dimethyl-5-{[N-(4-methylpentanoyl)-L-methionyl]amino}octanamide | CHEMBL461606 | 25163980 | XTRMRNMVFXWTCC-MLNNCEHLSA-N |
| Explore | None | AR9 | (2R,4S)-N-butyl-4-[(2S,5S,7R)-2,7-dimethyl-3,15-dioxo-1,4-diazacyclopentadecan-5-yl]-4-hydroxy-2-methylbutanamide | CHEMBL490304 | 25163981 | ZUIGWVKXPZANDI-MJCUULBUSA-N |
| Explore | None | AXF | (2R,4S)-N-BUTYL-4-HYDROXY-2-METHYL- 4-((E)-(4AS,12R,15S,17AS)-15-METHYL -14,17-DIOXO-2,3,4,4A,6,9,11,12,13, 14,15,16,17,17A-TETRADECAHYDRO-1H-5 ,10-DITHIA-1,13,16-TRIAZA-BENZOCYCL OPENTADECEN-12-YL)-BUTYRAMIDE | CHEMBL210240 | 9547929 | FIWCVIADXWJIGF-NFXSCPKSSA-N |
| Explore | None | AXQ | {(E)-(3R,6S,9R)-3-[(1S,3R)-3-((S)-1 -BUTYLCARBAMOYL-2-METHYL-PROPYLCARB AMOYL)-1-HYDROXY-BUTYL]-6-METHYL-5, 8-DIOXO-1,11-DITHIA-4,7-DIAZA-CYCLO PENTADEC-13-EN-9-YL}-CARBAMIC ACID TERT-BUTYL ESTER | CHEMBL377149 | 9547928 | YFVXRNZNJJXEKV-DYASFXQMSA-N |
| Explore | None | AYH | (1R,3S)-3-[1-(acetylamino)-1-methylethyl]-N-[(1S,2S,4R)-1-benzyl-5-(butylamino)-2-hydroxy-4-methyl-5-oxopentyl]cyclohexanecarboxamide | CHEMBL1093388 | 45259044 | NGUMIHCAWWHVPZ-MTKOPPBXSA-N |
| Explore | None | B00 | 2-amino-3-methyl-6-[(1S,2R)-2-phenylcyclopropyl]pyrimidin-4(3H)-one | CHEMBL2169926 | 66545742 | VTVXXFGROBMFAL-QWRGUYRKSA-N |
| Explore | None | B02 | 2-amino-3-methyl-6-[(1S,2R)-2-(3'-methylbiphenyl-4-yl)cyclopropyl]pyrimidin-4(3H)-one | CHEMBL2169939 | 66545744 | STUBOTPNCNDBOA-ROUUACIJSA-N |
| Explore | None | B7E | compound 28 | CHEMBL4117925 | 132068789 | LNZBKHMXPFCMOB-GLYDZZHWSA-N |
| Explore | None | B7T | (1r,4r)-4-methoxy-6'-(5-methyl-3-pyridinyl)-3'H-dispiro[cyclohexane-1,2'-indene-1',4''-[1,3]oxazol]-2''-amine | CHEMBL4116294 | n/a | XMEKMASQQBIQCX-VJBMBRPKSA-N |
| Explore | None | BAV | (3S,14R,16S)-16-[(1R)-1-hydroxy-2-{[3-(1-methylethyl)benzyl]amino}ethyl]-3,4,14-trimethyl-1,4-diazacyclohexadecane-2,5- dione | CHEMBL564010 | 25163982 | LHBBUGLYVFZUTH-GXVHRJHYSA-N |
| Explore | None | BDJ | (2Z)-3-(3-chlorobenzyl)-2-imino-5,5-dimethylimidazolidin-4-one | CHEMBL572367 | 45484188 | NFQQEWLVDJRZJJ-UHFFFAOYSA-N |
| Explore | None | BDO | (2Z,5R)-3-(3-chlorobenzyl)-2-imino-5-methyl-5-(2-methylpropyl)imidazolidin-4-one | None | 49866692 | SMHLWQCDIJPLEC-OAHLLOKOSA-N |
| Explore | None | BDQ | 1-(4-cyanophenyl)-3-(4-{[(2Z,4R)-2-imino-4-methyl-4-(2-methylpropyl)-5-oxoimidazolidin-1-yl]methyl}benzyl)urea | None | 49866693 | CTKHUQYUPSHMQE-XMMPIXPASA-N |
| Explore | None | BDV | 1-butyl-3-(4-{[(2Z,4R)-2-imino-4-methyl-4-(2-methylpropyl)-5-oxoimidazolidin-1-yl]methyl}benzyl)urea | None | 49866694 | VPGRKPRUHRVZER-OAQYLSRUSA-N |
| Explore | None | BDW | (4S)-1-(4-{[(2Z,4R)-4-(2-cyclohexylethyl)-4-(cyclohexylmethyl)-2-imino-5-oxoimidazolidin-1-yl]methyl}benzyl)-4-propylimidazolidin-2-one | CHEMBL1231280 | 11237963 | SILGEXOUELDSRZ-GMCHKSTQSA-N |
| Explore | None | BDX | (2E,5R)-5-(2-cyclohexylethyl)-5-(cyclohexylmethyl)-2-imino-3-methylimidazolidin-4-one | CHEMBL583178 | 11232421 | SVQNYPQKWMFQJJ-LJQANCHMSA-N |
| Explore | None | BJC | (1R,3S)-N-[(1S,2R)-1-benzyl-2-hydroxy-3-{[3-(1-methylethyl)benzyl]amino}propyl]-3-[1-methyl-1-(2-oxopiperidin-1-yl)ethy l]cyclohexanecarboxamide | None | 45259045 | MFPZDLDVZIAMTN-OKDNLZPVSA-N |
| Explore | None | BSD | N-{(1S,2R)-1-benzyl-2-hydroxy-3-[(3-methoxybenzyl)amino]propyl}-5-[methyl(methylsulfonyl)amino]-N'-[(1R)-1-phenylethyl]benzene-1,3-dicarboxamide | CHEMBL403268 | 24882306 | HIQWWDCRULXYDF-SWROZOJRSA-N |
| Explore | None | BUH | ~{N}-[6-[(3~{R},6~{R})-5-azanyl-3,6-dimethyl-6-(trifluoromethyl)-2~{H}-1,4-oxazin-3-yl]-5-fluoranyl-pyridin-2-yl]-3-chloranyl-5-(trifluoromethyl)pyridine-2-carboxamide | CHEMBL3670375 | 88602735 | PSBBWFNMHDUTRH-DLBZAZTESA-N |
| Explore | None | BX2 | (5S)-2-amino-5-(2,6-diethylpyridin-4-yl)-3-methyl-5-(3-pyrimidin-5-ylphenyl)-3,5-dihydro-4H-imidazol-4-one | CHEMBL590730 | 16726085 | QQPRKWVAAAEILV-QHCPKHFHSA-N |
| Explore | None | BXD | (3S,4S,5R)-3-(4-amino-3-{[(2R)-3-ethoxy-1,1,1-trifluoropropan-2-yl]oxy}-5-fluorobenzyl)-5-[(3-tert-butylbenzyl)amino]tetrahydro-2H-thiopyran-4-ol 1,1-dioxide | CHEMBL2048051 | 44625397 | UJZFSYZNJMWXJO-NJONLQHESA-N |
| Explore | None | BXQ | (3S,4S,5R)-3-{4-amino-3-fluoro-5-[(2S)-3,3,3-trifluoro-2-hydroxypropyl]benzyl}-5-[(3-tert-butylbenzyl)amino]tetrahydro-2H-thiopyran-4-ol 1,1-dioxide | CHEMBL2047912 | 44625098 | GCVKLIOGBJALOK-VPJOFFEXSA-N |
| Explore | None | C44 | N-{(1S,2R)-1-benzyl-2-hydroxy-3-[(1S)-1,2,3,4-tetrahydronaphthalen-1-ylamino]propyl}-3-(1,1-dioxido-1,2-thiazinan-2-yl)-5-(ethylamino)benzamide | None | 23657803 | OAOKRIOFVOASEG-OWHBQTKESA-N |
| Explore | None | C6A | N-[(2S,3R)-4-{[(2R,4S)-2-cyclopropyl-6-(2,2-dimethylpropyl)-3,4-dihydro-2H-chromen-4-yl]amino}-1-(3,5-difluorophenyl)-3-hydroxybutan-2-yl]acetamide | None | 56851695 | IBLLHMQPQAMFLM-WDTRASESSA-N |
| Explore | None | C6R | N-[3-[(4S,5R)-2-azanyl-4-methyl-5-phenyl-5,6-dihydro-1,3-thiazin-4-yl]-4-fluoranyl-phenyl]-5-(fluoranylmethoxy)pyrazine-2-carboxamide | CHEMBL4473080 | 138857908 | BCDWEYSMCDBNJS-UZUQRXQVSA-N |
| Explore | None | C6U | N-[3-[(4S)-2-azanyl-4-methyl-5,6-dihydro-1,3-thiazin-4-yl]-4-fluoranyl-phenyl]-5-chloranyl-pyridine-2-carboxamide | CHEMBL2347211 | 50938551 | VVZZZUNCWSTIOI-KRWDZBQOSA-N |
| Explore | None | C7O | N-[3-[(5R)-3-azanyl-5-methyl-9,9-bis(oxidanylidene)-2,9$l^{6}-dithia-4-azaspiro[5.5]undec-3-en-5-yl]-4-fluoranyl-phenyl]-5-(fluoranylmethoxy)pyrazine-2-carboxamide | CHEMBL4465534 | 138454796 | DZTJZUAOGBUBNK-HXUWFJFHSA-N |
| Explore | None | C7X | N-[3-[(4S,5S)-2-azanyl-4-methyl-5-phenyl-5,6-dihydro-1,3-thiazin-4-yl]-4-fluoranyl-phenyl]-5-(fluoranylmethoxy)pyrazine-2-carboxamide | CHEMBL4463201 | 138857909 | BCDWEYSMCDBNJS-GAJHUEQPSA-N |
| Explore | None | C83 | N-[3-[(4R,5R,6R)-2-azanyl-5-fluoranyl-4,6-dimethyl-5,6-dihydro-1,3-thiazin-4-yl]-4-fluoranyl-phenyl]-5-(fluoranylmethoxy)pyrazine-2-carboxamide | CHEMBL4557670 | 91971958 | JWJQXZNLFNMIHE-AHRODOEDSA-N |
| Explore | None | C86 | N-[3-[(4S,6S)-2-azanyl-4-methyl-6-(trifluoromethyl)-5,6-dihydro-1,3-thiazin-4-yl]-4-fluoranyl-phenyl]-5-(fluoranylmethoxy)pyrazine-2-carboxamide | None | 139600334 | JRPAQOLQALFUAQ-GUYCJALGSA-N |
| Explore | None | CL | CHLORIDE ION | None | 312 | VEXZGXHMUGYJMC-UHFFFAOYSA-M |
| Explore | None | CM7 | N-[(1S,2R)-1-benzyl-2-hydroxy-3-{[3-(trifluoromethyl)benzyl]amino}propyl]-7-ethyl-1-methyl-3,4-dihydro-1H-[1,2,5]thiadiazepino[3,4,5-hi]indole-9-carboxamide 2,2-dioxide | CHEMBL554349 | 11296859 | MSHYGGHZTGSTOG-LMSSTIIKSA-N |
| Explore | None | CM8 | N-[(1S,2R)-1-benzyl-2-hydroxy-3-{[3-(trifluoromethyl)benzyl]amino}propyl]-3-(1,1-dioxido-1,2-thiazinan-2-yl)-5-(ethylamino)benzamide | CHEMBL401473 | 24794397 | GPMRAYXRPZKTFK-URLMMPGGSA-N |
| Explore | None | CS5 | N'-{(1S,2R)-1-(3,5-DIFLUOROBENZYL)-2-HYDROXY-3-[(3-METHOXYBENZYL)AMINO]PROPYL}-5-METHYL-N,N-DIPROPYLISOPHTHALAMIDE | CHEMBL221597 | 9916309 | JEEOUWBWJFSMIP-IOWSJCHKSA-N |
| Explore | None | CS7 | N'-[(1S,2R)-2-[(2R,4R)-4-(BENZYLOXY)PYRROLIDIN-2-YL]-1-(3,5-DIFLUOROBENZYL)-2-HYDROXYETHYL]-5-METHYL-N,N-DIPROPYLISOPHTHALAMIDE | CHEMBL270359 | 11556254 | GZHSLBYVXGDJDF-NXVJRICRSA-N |
| Explore | None | CS9 | N'-{(1S,2R)-1-(3,5-DIFLUOROBENZYL)-2-HYDROXY-2-[(2R,4R)-4-PHENOXYPYRROLIDIN-2-YL]ETHYL}-5-METHYL-N,N-DIPROPYLISOPHTHALAMIDE | CHEMBL403727 | 11614083 | YDCNYSQITCUGST-FEFKUCBWSA-N |
| Explore | None | D8Y | 3-[2-(3-chlorophenyl)ethyl]pyridin-2-amine | CHEMBL575232 | 44552609 | XJCJGDOLNLEZIY-UHFFFAOYSA-N |
| Explore | None | D9W | ~{N}-[3-[(3~{R})-5-azanyl-3-methyl-2,6-dihydro-1,4-oxazin-3-yl]phenyl]-5-bromanyl-pyridine-2-carboxamide | CHEMBL3653341 | 50913659 | HALWMQVNBCAXRZ-KRWDZBQOSA-N |
| Explore | None | DJS | 2-{[(2S)-butan-2-yl]amino}-N-{(1R,2S)-1-hydroxy-3-phenyl-1-[(2R)-pyrrolidin-2-yl]propan-2-yl}-6-(methylsulfonyl)pyridine-4-carboxamide | CHEMBL4117641 | 131800991 | CNZLAHITQXPOEJ-YLTWVVNKSA-N |
| Explore | None | DJV | N-[(1R,2S)-1-[(2R,4R)-4-(cyclohexylmethoxy)pyrrolidin-2-yl]-3-(3,5-difluorophenyl)-1-hydroxypropan-2-yl]acetamide | CHEMBL4116622 | 131800992 | MSAOCNJMXAZEEN-YUMYIRISSA-N |
| Explore | None | DK7 | N-[(1S,2S)-1-[(3R,6R)-6-(cyclohexylmethoxy)morpholin-3-yl]-3-(3,5-difluorophenyl)-1-hydroxypropan-2-yl]acetamide | CHEMBL4116001 | 131800993 | XQHQHHREHKYCIG-CBPXPLCBSA-N |
| Explore | None | DKJ | N-{(1S,2S)-3-(3,5-difluorophenyl)-1-[(3R,5S,6R)-6-(2,2-dimethylpropoxy)-5-methylmorpholin-3-yl]-1-hydroxypropan-2-yl}acetamide | CHEMBL4116547 | 11669599 | MTSIVXGKWLWPKB-VVEMMYRFSA-N |
| Explore | None | DWA | (4R)-4-[3-(2-fluoropyridin-3-yl)phenyl]-4-(4-methoxyphenyl)-4,5-dihydro-1,3-oxazol-2-amine | None | 137349207 | WCJQDRXUNINKDD-OAQYLSRUSA-N |
| Explore | None | DWB | (4S)-2'-(5-chloro-2-fluorophenyl)-7'-methoxyspiro[1,3-oxazole-4,9'-xanthen]-2-amine | None | 45255110 | WIRKEQRUHLXVOQ-QFIPXVFZSA-N |
| Explore | None | DWD | (4S)-2'-(2-methylpropoxy)-7'-(pyrimidin-5-yl)spiro[1,3-oxazole-4,9'-xanthen]-2-amine | CHEMBL2177343 | 45256294 | JWSHQJYDXNPIKG-QHCPKHFHSA-N |
| Explore | None | E4A | (4S)-19-acetyl-4-[(1R)-1-hydroxy-2-({1-[3-(propan-2-yl)phenyl]cyclopropyl}amino)ethyl]-11-oxa-3,16-diazatricyclo[15.3.1.1~6,10~]docosa-1(21),6(22),7,9,17,19-hexaen-2-one | None | 67440750 | LUJWXMKDHHFLOK-JHOUSYSJSA-N |
| Explore | None | E4G | (4S)-4-[(1R)-1-hydroxy-2-({[3-(propan-2-yl)phenyl]methyl}amino)ethyl]-19-(2-oxopropoxy)-11,16-dioxa-3-azatricyclo[15.3.1.1~6,10~]docosa-1(21),6(22),7,9,17,19-hexaen-2-one | None | n/a | MKUSLLRHQBCOIB-JHOUSYSJSA-N |
| Explore | None | E4J | 2-(butylamino)-N-[(2S,3S,5R)-6-(butylamino)-3-hydroxy-5-methyl-6-oxo-1-phenylhexan-2-yl]-6-methoxypyridine-4-carboxamide | None | 146048092 | XXAQWIHKXZOYLW-QDSKXPNFSA-N |
| Explore | None | E4Y | (2R,4S)-N-butyl-4-[(4S,6R)-16-ethoxy-12-ethyl-6-methyl-2,13-dioxo-3,12-diazabicyclo[12.3.1]octadeca-1(18),14,16-trien-4-yl]-4-hydroxy-2-methylbutanamide | None | 68541056 | SQQOMEGTQPPAAA-SZUBIPLGSA-N |
| Explore | None | E51 | (2R,4S)-N-butyl-4-[(5S,8S,10R)-5,10-dimethyl-3,3,6-trioxo-3lambda~6~-thia-7-azabicyclo[11.3.1]heptadeca-1(17),13,15-trien-8-yl]-4-hydroxy-2-methylbutanamide | None | 69007077 | RYVHNXNTYFQKLT-FSQPGOEKSA-N |
| Explore | None | E5A | (10S,13S)-13-[(1R)-1-hydroxy-2-({[3-(propan-2-yl)phenyl]methyl}amino)ethyl]-9,10-dimethyl-2-oxa-9,12-diazabicyclo[13.3.1]nonadeca-1(19),15,17-triene-8,11-dione | None | 67375400 | FUURZWWGPRBEOS-QLCOJLISSA-N |
| Explore | None | E5D | (9R,11S)-3-ethyl-11-[(1R)-1-hydroxy-2-({[3-(propan-2-yl)phenyl]methyl}amino)ethyl]-9-methyl-3,12-diazabicyclo[12.3.1]octadeca-1(18),14,16-triene-2,13-dione | None | 68538837 | MYMHIVTZLXPTIU-LDVROUIZSA-N |
| Explore | None | E5P | (9R,11S)-11-[(1R)-1-hydroxy-2-({[3-(propan-2-yl)phenyl]methyl}amino)ethyl]-9-methyl-16-(1,3-oxazol-2-yl)-3-[(1R)-1-phenylethyl]-3,12-diazabicyclo[12.3.1]octadeca-1(18),14,16-triene-2,13-dione | None | 146048094 | WTVYZBOJEASHJM-PMKGPLEQSA-N |
| Explore | None | E5V | (4S)-4-{(S)-hydroxy[(3R,6R)-6-(methoxymethyl)morpholin-3-yl]methyl}-19-(methoxymethyl)-11-oxa-3,16-diazatricyclo[15.3.1.1~6,10~]docosa-1(21),6(22),7,9,17,19-hexaen-2-one | None | 146048095 | ZMVXRCDFLHBKCX-RAVGUYNFSA-N |
| Explore | None | E5Y | (5S,8S,10R)-8-[(1R)-1-hydroxy-2-{[(5-propyl-1H-pyrazol-3-yl)methyl]amino}ethyl]-4,5,10-trimethyl-1-oxa-4,7-diazacyclohexadecane-3,6-dione | None | 146048096 | NLWPKRWRLRUIHJ-CQIJRDABSA-N |
| Explore | None | E61 | (10S,12S)-12-[(1R)-1-hydroxy-2-({[3-(propan-2-yl)phenyl]methyl}amino)ethyl]-17-(methoxymethyl)-10-methyl-7-oxa-2,13-diazabicyclo[13.3.1]nonadeca-1(19),15,17-trien-14-one | None | 146048097 | IFMINNXVEWATNC-GOQOSDJISA-N |
| Explore | None | E6J | (4S)-4-[(1R)-1-hydroxy-2-({[3-(propan-2-yl)phenyl]methyl}amino)ethyl]-19-(methoxymethyl)-11,16-dioxa-3-azatricyclo[15.3.1.1~6,10~]docosa-1(21),6(22),7,9,17,19-hexaen-2-one | None | 69227323 | NGMBHSPURAEOBG-AJQTZOPKSA-N |
| Explore | None | E6M | (10R,12S)-12-[(1R)-1-hydroxy-2-({[3-(propan-2-yl)phenyl]methyl}amino)ethyl]-17-(methoxymethyl)-10-methyl-2,13-diazabicyclo[13.3.1]nonadeca-1(19),15,17-trien-14-one | None | 146048098 | UGCIUWIDOWOQSA-XGJRVREISA-N |
| Explore | None | E6P | (10S,12S)-17-chloro-12-[(1R)-1-hydroxy-2-({[3-(propan-2-yl)phenyl]methyl}amino)ethyl]-10-methyl-7-oxa-2,13,18-triazabicyclo[13.3.1]nonadeca-1(19),15,17-trien-14-one | None | 146048100 | MHXXUEKCLLRUIA-DCEDVJGZSA-N |
| Explore | None | E6S | (3S,14R,16S)-16-[1,1-dihydroxy-2-({[3-(propan-2-yl)phenyl]methyl}amino)ethyl]-3,4,14-trimethyl-1,4-diazacyclohexadecane-2,5-dione | None | 146048101 | PVWMLHVFMZYBAR-UMFSSWHCSA-N |
| Explore | None | E6V | (3S,14R,16S)-16-[(1R)-2-{[(4S)-2,2-dimethyl-6-(propan-2-yl)-3,4-dihydro-2H-1-benzopyran-4-yl]amino}-1-hydroxyethyl]-3,4,14-trimethyl-1,4-diazacyclohexadecane-2,5-dione | CHEMBL558488 | 42636932 | MNENNUUKHSBOKZ-BEOVBFIISA-N |
| Explore | None | E6Y | (5S,8S,10R)-8-[(1R)-2-{[1-(3-tert-butylphenyl)cyclopropyl]amino}-1-hydroxyethyl]-4,5,10-trimethyl-1-oxa-4,7-diazacyclohexadecane-3,6-dione | None | 68942945 | DTTFGMDFRQRNPI-GXVHRJHYSA-N |
| Explore | None | E74 | (4S)-4-[(1R)-1-hydroxy-2-({[3-(propan-2-yl)phenyl]methyl}amino)ethyl]-18-methoxy-3,15,17-triazatricyclo[14.3.1.1~6,10~]henicosa-1(20),6(21),7,9,16,18-hexaen-2-one | None | 69224554 | LKVVVVQQVFSHRO-WUFINQPMSA-N |
| Explore | None | E77 | (4S)-4-[(1R)-1,2-dihydroxyethyl]-N,N-dimethyl-2-oxo-11,16-dioxa-3-azatricyclo[15.3.1.1~6,10~]docosa-1(21),6(22),7,9,17,19-hexaene-19-carboxamide | None | 146048106 | YKCXDIPNOWOCAE-VXKWHMMOSA-N |
| Explore | None | E7A | (10R,12S)-12-[(1R)-1,2-dihydroxyethyl]-N,N,10-trimethyl-14-oxo-2-oxa-13-azabicyclo[13.3.1]nonadeca-1(19),15,17-triene-17-carboxamide | None | 146048107 | FIDGRIKGIUHGAW-CZAAIQMYSA-N |
| Explore | None | EDO | 1,2-ETHANEDIOL | CHEMBL457299 | 174 | LYCAIKOWRPUZTN-UHFFFAOYSA-N |
| Explore | None | EJ7 | N-{3-[(1R,5S,6R)-3-amino-5-methyl-2-oxa-4-azabicyclo[4.1.0]hept-3-en-5-yl]-4-fluorophenyl}-5-methoxypyrazine-2-carboxamide | CHEMBL3693258 | 90411858 | LUOFRFUNXXGHFC-UCMVZMLTSA-N |
| Explore | None | EV0 | 2-amino-6-propylpyrimidin-4(3H)-one | CHEMBL235825 | 135556691;22394971 | FSYKBAWAYYELHH-UHFFFAOYSA-N |
| Explore | None | EV2 | 3-pyrrolidin-1-ylquinoxalin-2-amine | CHEMBL1232596 | 2041326 | LWWDIFFPFOZSSB-UHFFFAOYSA-N |
| Explore | None | EV3 | 3-(2-amino-5-chloro-1H-benzimidazol-1-yl)propan-1-ol | CHEMBL1221922 | 2950966 | NSMVCZCLMLZSOB-UHFFFAOYSA-N |
| Explore | None | EV4 | 4-(2-amino-5-chloro-1H-benzimidazol-1-yl)-N-cyclohexyl-N-methylbutanamide | CHEMBL1221977 | 46238535 | UIWHCBCBZBYNDS-UHFFFAOYSA-N |
| Explore | None | EV5 | (3S)-3-(2-amino-5-chloro-1H-benzimidazol-1-yl)-N-(cyclohexylmethyl)pentanamide | CHEMBL1222240 | 46238536 | UKACQFCXAAAWAE-HNNXBMFYSA-N |
| Explore | None | EV6 | (3S)-3-(2-amino-5-chloro-1H-benzimidazol-1-yl)-N-[(1R,3S,5R,7R)-tricyclo[3.3.1.1~3,7~]dec-2-yl]pentanamide | None | n/a | KMAKOMVKNWTGPE-LIXZBVSLSA-N |
| Explore | None | F1M | N-{1-[5-chloro-3-methoxy-2-(1-methylethoxy)benzyl]piperidin-4-yl}-2-(4-sulfamoylphenoxy)acetamide | None | 25134254 | QVZLZLJHCAPQQC-UHFFFAOYSA-N |
| Explore | None | F1N | N-{1-[5-chloro-3-methoxy-2-(1-methylethoxy)benzyl]piperidin-4-yl}-2-(2-methyl-4-sulfamoylphenoxy)acetamide | None | 25134255 | IWMCULWPLNDDNK-UHFFFAOYSA-N |
| Explore | None | F2I | N'-{(1S,2R)-1-(3,5-DIFLUOROBENZYL)-2-HYDROXY-3-[(3-IODOBENZYL)AMINO]PROPYL}-5-METHYL-N,N-DIPROPYLISOPHTHALAMIDE | CHEMBL373533 | 11628951 | FSQSHDXWJKXBPP-XZWHSSHBSA-N |
| Explore | None | FRP | N1-((2S,3S,5R)-3-AMINO-6-(4-FLUOROPHENYLAMINO)-5-METHYL-6-OXO-1-PHENYLHEXAN-2-YL)-N3,N3-DIPROPYLISOPHTHALAMIDE | CHEMBL200077 | 5494423 | PZHFCAIXAVDQAK-STQWGSIPSA-N |
| Explore | None | G00 | 4-butoxy-3-chlorobenzyl imidothiocarbamate | CHEMBL568966 | 1609819 | IONZMLSFEITLRK-UHFFFAOYSA-N |
| Explore | None | GHJ | (3R,3aR,6aS)-N-[(4R,7S,8S,10R,13S)-8-hydroxy-10,17-dimethyl-7-(2-methylpropyl)-5,11,14-trioxo-13-(propan-2-yl)-2-thia-6,12,15-triazaoctadecan-4-yl]hexahydrofuro[3,2-d][1,2]oxazole-3-carboxamide | None | 137349429 | FHZUZMVZKPPWHG-VRUQXOILSA-N |
| Explore | None | GMF | 2-[[3-(3-methoxyphenyl)phenyl]-(4-pyridyl)methyl]guanidine | None | 71627364 | LSPQISZRKHVJOD-LJQANCHMSA-N |
| Explore | None | GTU | N-[3-[(4R)-2-azanyl-4-prop-1-ynyl-5,6-dihydro-1,3-oxazin-4-yl]-4-fluoranyl-phenyl]-5-cyano-pyridine-2-carboxamide | CHEMBL4852444 | 118399583 | DWCWSXLKLMTBSD-FQEVSTJZSA-N |
| Explore | None | GUC | N-[3-[(3S)-1-azanyl-5-fluoranyl-3-methyl-4H-2,6-naphthyridin-3-yl]-4-fluoranyl-phenyl]-5-cyano-3-methyl-pyridine-2-carboxamide | None | 156022485 | UOHLPZVSOSMODJ-QHCPKHFHSA-N |
| Explore | None | GX6 | N-[3-[(9S)-7-azanyl-2,2-bis(fluoranyl)-9-prop-1-ynyl-6-oxa-8-azaspiro[3.5]non-7-en-9-yl]-4-fluoranyl-phenyl]-5-cyano-pyridine-2-carboxamide | None | 155818878 | GBDJTQDCHCBNSY-HSZRJFAPSA-N |
| Explore | None | HRV | N-{3-[(2R,3R)-5-amino-3-methyl-2-(trifluoromethyl)-3,6-dihydro-2H-1,4-oxazin-3-yl]-4-fluorophenyl}-3,5-dichloropyridine-2-carboxamide | None | 139030249 | VLILPGWCHAEKPY-IAGOWNOFSA-N |
| Explore | None | I02 | 3-{5-[(1R)-1-AMINO-1-METHYL-2-PHENYLETHYL]-1,3,4-OXADIAZOL-2-YL}-N-[(1R)-1-(4-FLUOROPHENYL)ETHYL]-5-[METHYL(METHYLSULFONYL)AMINO]BENZAMIDE | CHEMBL219601 | 11692473 | QEJSJQVKMSAHHX-KWMCUTETSA-N |
| Explore | None | I03 | (2S)-2-AMINO-2-BENZYL-3-HYDROXYPROPYL 3-({[(1R)-1-(4-FLUOROPHENYL)ETHYL]AMINO}CARBONYL)-5-[METHYL(METHYLSULFONYL)AMINO]BENZOATE | None | 11963550 | JVYHUOIVVLDSHT-GDJIYFAZSA-N |
| Explore | None | I21 | 2-[(5R)-5-amino-5-methyl-4,16-dioxo-14-phenyl-3-oxa-15-azatricyclo[15.3.1.1~7,11~]docosa-1(21),7(22),8,10,12,14,17,19-octaen-19-yl]benzonitrile | None | 163184952 | GWSQLGYWQZHSHS-UUWRZZSWSA-N |
| Explore | None | I6X | 5-{(1R)-3-amino-4-fluoro-1-[3-(5-prop-1-yn-1-ylpyridin-3-yl)phenyl]-1H-isoindol-1-yl}-1-ethyl-3-methylpyridin-2(1H)-one | CHEMBL2152903 | 57406537 | TUGLMYZSOPKJOA-PMERELPUSA-N |
| Explore | None | III | ~{N},~{N}-dimethyl-2-pyrrolidin-1-yl-quinazolin-4-amine | None | 52108499 | VONNLDQOEHSECV-UHFFFAOYSA-N |
| Explore | None | IOD | IODIDE ION | None | 30165 | XMBWDFGMSWQBCA-UHFFFAOYSA-M |
| Explore | None | IXS | N-[(1S)-1-benzyl-2-{[(1S)-2-(isobutylamino)-1-methyl-2-oxoethyl]amino}ethyl]-N'-[(1R)-1-(4-fluorophenyl)ethyl]-5-[methyl(methylsulfonyl)amino]isophthalamide | CHEMBL379513 | 23644701 | FZTXBRKPIRTQCY-QEGDFHJFSA-N |
| Explore | None | KGG | (3R,5R)-3-methoxy-5-(4-methoxyphenyl)-5-(3-pyridin-3-ylphenyl)-3,4-dihydropyrrol-2-amine | None | 71681797 | XBWQSEBJKSPBBV-FYYLOGMGSA-N |
| Explore | None | L00 | (2R)-2-(5-{3-chloro-6-((2-methoxyethyl){[(1S,2S)-2-methylcyclopropyl]methyl}amino)-2-[methyl(methylsulfonyl)amino]pyrid in-4-yl}-1,3,4-oxadiazol-2-yl)-1-phenylpropan-2-amine | CHEMBL1088070 | 17749716 | NIFMMESJJLKLHP-BNJIMDBKSA-N |
| Explore | None | L01 | 3-[({(1S,2R)-1-BENZYL-2-HYDROXY-3-[(3-METHOXYBENZYL)AMINO]PROPYL}AMINO)(HYDROXY)METHYL]-N,N-DIPROPYLBENZAMIDE | CHEMBL443239 | 449107 | WPRACYICKOKGTO-XZWHSSHBSA-N |
| Explore | None | L3J | (E)-N-(2-methylpropylidene)-N~2~-{[(4S)-17-[(methylsulfonyl)(propyl)amino]-2-oxo-3-azatricyclo[13.3.1.1~6,10~]icosa-1(19),6(20),7,9,15,17-hexaen-4-yl]methyl}-D-threoninamide | None | n/a | DQMUZJCEBNKYBU-PQJSMVLXSA-N |
| Explore | None | L3M | (3S)-3-hydroxy-N-(2-methylpropyl)-N~2~-{[(4S)-17-[(methylsulfonyl)(propyl)amino]-2-oxo-3-azatricyclo[13.3.1.1~6,10~]icosa-1(19),6(20),7,9,15,17-hexaen-4-yl]methyl}-L-norleucinamide | None | 139209087 | BUVUUWHTEARFCT-GOBOWQCMSA-N |
| Explore | None | L4J | N-(2-methylpropyl)-N~2~-{[(4S)-17-[(methylsulfonyl)(propyl)amino]-2-oxo-3-azatricyclo[13.3.1.1~6,10~]icosa-1(19),6(20),7,9,15,17-hexaen-4-yl]methyl}-L-norleucinamide | CHEMBL385374 | 11606910 | JRTACURQOKVHSE-CDZUIXILSA-N |
| Explore | None | LIJ | BENZYL [(1S)-2-({(1S,2R)-1-BENZYL-2-HYDROXY-3-[(3-METHOXYBENZYL)AMINO]PROPYL}AMINO)-2-OXO-1-{[(1-PROPYLBUTYL)SULFONYL]METHYL}ETHYL]CARBAMATE | None | 15942666 | FJYALDRNDKNYKU-LBFZIJHGSA-N |
| Explore | None | LIQ | N-{(1S)-2-({(1S,2R)-1-(3,5-DIFLUOROBENZYL)-3-[(3-ETHYLBENZYL)AMINO]-2-HYDROXYPROPYL}AMINO)-2-OXO-1-[(PENTYLSULFONYL)METHYL]ETHYL}NICOTINAMIDE | None | 15942667 | IOTPZWJUHSYLHJ-OJDZSJEKSA-N |
| Explore | None | LPD | L-PROLINAMIDE | CHEMBL1222059 | 111306 | VLJNHYLEOZPXFW-BYPYZUCNSA-N |
| Explore | None | M7D | N-{3-[(3R)-1-amino-3-methyl-3,4-dihydropyrrolo[1,2-a]pyrazin-3-yl]-4-fluorophenyl}-5-cyanopyridine-2-carboxamide | CHEMBL3261075 | 90656190 | FZFJUKOAGOAQFB-NRFANRHFSA-N |
| Explore | None | MR0 | N~3~-{(1S,2R)-1-(3,5-DIFLUOROBENZYL)-2-HYDROXY-3-[(3-METHOXYBENZYL)AMINO]PROPYL}-N~1~,N~1~-DIPROPYLBENZENE-1,3,5-TRICARBOXAMIDE | CHEMBL396765 | 16129583 | XIQAKRFMIYGAIR-XZWHSSHBSA-N |
| Explore | None | MV7 | N-[(2S,3S,5R)-1-(3,5-difluorophenoxy)-3-hydroxy-5-(2-methoxyethoxy)-6-[[(2S)-3-methyl-1-oxo-1-(phenylmethylamino)butan-2-yl]amino]-6-oxo-hexan-2-yl]-5-(methyl-methylsulfonyl-amino)-N'-[(1R)-1-phenylethyl]benzene-1,3-dicarboxamide | CHEMBL591644 | 25157024 | RSTFVOGBJGGSOD-NDKACYJFSA-N |
| Explore | None | MY9 | N-{(1S,2S)-1-BENZYL-2-HYDROXY-2-[(4S)-1,2,2-TRIMETHYL-5-OXOIMIDAZOLIDIN-4-YL]ETHYL}-N'-[(1R)-1-(4-FLUOROPHENYL)ETHYL]-5-[METHYL(METHYLSULFONYL)AMINO]ISOPHTHALAMIDE | CHEMBL1234552 | 16741230 | YNXGIROKYOHHJW-UFAZYNLISA-N |
| Explore | None | NA | SODIUM ION | None | 923 | FKNQFGJONOIPTF-UHFFFAOYSA-N |
| Explore | None | NI | NICKEL (II) ION | None | 934 | VEQPNABPJHWNSG-UHFFFAOYSA-N |
| Explore | None | P6J | N-{3-[(1S,5S,6S)-3-amino-1-(methoxymethyl)-5-methyl-2-thia-4-azabicyclo[4.1.0]hept-3-en-5-yl]-4,5-difluorophenyl}-5-[(prop-2-yn-1-yl)oxy]pyrazine-2-carboxamide | CHEMBL4560579 | 118866105 | IPUJINDWAGRAHN-KNXBSLHKSA-N |
| Explore | None | P6U | (4S)-4-[2,4-difluoro-5-({[1-(trifluoromethyl)cyclopropyl]amino}methyl)phenyl]-4-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine | CHEMBL4098403 | 123132907 | XKONRMXLBXCJAM-AWEZNQCLSA-N |
| Explore | None | PB0 | (2S)-2-[(3R)-3-(acetylamino)-3-(2-methylpropyl)-2-oxopyrrolidin-1-yl]-N-{(1R,2S)-3-(3,5-difluorophenyl)-1-hydroxy-1-[(2R,4R)-4-propoxypyrrolidin-2-yl]propan-2-yl}-4-phenylbutanamide | CHEMBL1915990 | 11578322 | LPZOLMFQGUDKQH-ZXWXCOCLSA-N |
| Explore | None | PB7 | (2S)-2-{(3S)-3-(acetylamino)-3-[(2S)-butan-2-yl]-2-oxopyrrolidin-1-yl}-N-{(2S,3R)-3-hydroxy-4-[(3-methoxybenzyl)amino]-1-phenylbutan-2-yl}-4-phenylbutanamide | None | 53346502 | SMPAHDBHYSCFQF-SXXDCNOLSA-N |
| Explore | None | PB8 | (2S)-2-[(3R)-3-(acetylamino)-3-(2-methylpropyl)-2-oxopyrrolidin-1-yl]-N-{(1R,2S)-3-(3,5-difluorophenyl)-1-hydroxy-1-[(3R)-1,2,3,4-tetrahydroisoquinolin-3-yl]propan-2-yl}-4-phenylbutanamide | CHEMBL1915985 | 24997667 | JJJDOYFRIVNWHV-WUCUQKTKSA-N |
| Explore | None | PEG | DI(HYDROXYETHYL)ETHER | CHEMBL1235226 | 8117 | MTHSVFCYNBDYFN-UHFFFAOYSA-N |
| Explore | None | QBH | (4S)-4-(2-hydroxy-5-{[(3S,4S,5R)-4-hydroxy-1,1-dioxido-5-{[3-(propan-2-yl)benzyl]amino}tetrahydro-2H-thiopyran-3-yl]methyl}benzyl)-3-propyl-1,3-oxazolidin-2-one | CHEMBL1615184 | 50937466 | JYNDAPHZRSRSGI-KAHNYGAISA-N |
| Explore | None | QIN | N-[(1S,2S)-2-AMINO-1-(3-THIENYLMETHYL)HEXYL]-2-({[(1S,2S)-2-METHYLCYCLOPROPYL]METHYL}AMINO)-6-[METHYL(METHYLSULFONYL)AMINO]ISONICOTINAMIDE | None | 16741220 | MSSOOXCWRUWADA-CZGNIMDHSA-N |
| Explore | None | QJJ | N-{(1S,2S)-2-[(4aS,7aR)-2-amino-4a,5-dihydro-4H-furo[3,4-d][1,3]thiazin-7a(7H)-yl]cyclopropyl}-5-fluoropyridine-2-carboxamide | CHEMBL4637568 | 145704715 | OWWIYTVWTQBRDL-FGAILIKWSA-N |
| Explore | None | QJM | N-{(1R,2R)-2-[(4aS,7aR)-2-amino-4a,5-dihydro-4H-furo[3,4-d][1,3]thiazin-7a(7H)-yl]cyclopropyl}-5-fluoropyridine-2-carboxamide | None | 145704716 | OWWIYTVWTQBRDL-RAAPYIGPSA-N |
| Explore | None | QJP | (1R,2R)-2-[(4aS,7aR)-2-amino-4a,5-dihydro-4H-furo[3,4-d][1,3]thiazin-7a(7H)-yl]-N-{[(1R,2R)-2-methylcyclopropyl]methyl}cyclopropane-1-carboxamide | CHEMBL4644249 | 145704718 | FKPBYKKZZCOMKI-MIDHOLSSSA-N |
| Explore | None | QJV | (1R,2R)-2-[(4aS,7aR)-2-amino-4a,5-dihydro-4H-furo[3,4-d][1,3]thiazin-7a(7H)-yl]-N-butylcyclopropane-1-carboxamide | CHEMBL4642463 | 145704717 | WVAFMFLAAGBATC-OXIWPEFWSA-N |
| Explore | None | QK7 | (4aR,7aR)-7a-[(1R,2R)-2-(2-{[(1R,2R)-2-methylcyclopropyl]methoxy}propan-2-yl)cyclopropyl]-6-(pyrimidin-2-yl)-4,4a,5,6,7,7a-hexahydropyrrolo[3,4-d][1,3]thiazin-2-amine | CHEMBL4637426 | 145704720 | BFGQEVKVRRYAQC-IFEDNLKFSA-N |
| Explore | None | QKA | (1R,2R)-2-[(4aR,7aR)-2-amino-6-(pyrimidin-2-yl)-4a,5,6,7-tetrahydropyrrolo[3,4-d][1,3]thiazin-7a(4H)-yl]-N-{[(1R,2R)-2-methylcyclopropyl]methyl}cyclopropane-1-carboxamide | CHEMBL4643727 | 145704719 | UKXLLHCQBVONES-MPDRSUQMSA-N |
| Explore | None | QN7 | (8S)-3,3-DIFLUORO-8-(2'-FLUORO-3'-METHOXYBIPHENYL-3-YL)-8-PYRIDIN-4-YL-2,3,4,8-TETRAHYDROIMIDAZO[1,5-A]PYRIMIDIN-6-AMINE | CHEMBL3260842 | 90656184 | RECVUKARQVUVBY-XMMPIXPASA-N |
| Explore | None | QUD | 2-AMINO-3-{(1R)-1-CYCLOHEXYL-2-[(CYCLOHEXYLCARBONYL)AMINO]ETHYL}-6-PHENOXYQUINAZOLIN-3-IUM | None | 44631815 | JJSGXQVHJOYNEC-MHZLTWQESA-O |
| Explore | None | RSV | 6-(thiophen-3-yl)quinolin-2-amine | CHEMBL1821801 | 53346492 | SKHMHSCEONTQTF-UHFFFAOYSA-N |
| Explore | None | RTH | 6-[2-(3,3-dimethylbut-1-yn-1-yl)phenyl]quinolin-2-amine | CHEMBL1821808 | 53346493 | IFUYBWIZKMAADM-UHFFFAOYSA-N |
| Explore | None | RTM | 3-(2-aminoquinolin-3-yl)-N-cyclohexyl-N-methylpropanamide | CHEMBL1821809 | 53346494 | GRFOHUBBUMAJMM-UHFFFAOYSA-N |
| Explore | None | RTN | 3-[2-amino-6-(2-methylphenyl)quinolin-3-yl]-N-cyclohexylpropanamide | CHEMBL1821811 | 53236890 | JBOWUKRDBGMOJZ-UHFFFAOYSA-N |
| Explore | None | RVI | (2R)-2-{[2-amino-6-(2-methylphenyl)quinolin-3-yl]methyl}-N-(cyclohexylmethyl)pentanamide | None | 53346496 | KSRGIPYZQZCBMH-HSZRJFAPSA-N |
| Explore | None | S8Z | (8R)-8-[4-(DIFLUOROMETHOXY)PHENYL]-3,3-DIFLUORO-8-[3-(3-METHOXYPROP-1-YN-1-YL)PHENYL]-2,3,4,8-TETRAHYDROIMIDAZO[1,5-A]PYRIMIDIN-6-AMINE | None | 137349986 | DOQWIXXNZSOWDD-HSZRJFAPSA-N |
| Explore | None | SC6 | N-{(1S,2R)-1-(3,5-DIFLUOROBENZYL)-2-HYDROXY-2-[(2R,4R)-4-PHENOXYPYRROLIDIN-2-YL]ETHYL}-3-{[(2R)-2-(METHOXYMETHYL)PYRROLIDIN-1-YL]CARBONYL}-5-METHYLBENZAMIDE | CHEMBL403195 | 11578047 | KYHYNSQLYDXSNK-MXWGZHRFSA-N |
| Explore | None | SC7 | N'-{(1S,2R)-1-(3,5-DIFLUOROBENZYL)-2-[(2R,4S)-4-ETHOXYPIPERIDIN-2-YL]-2-HYDROXYETHYL}-5-METHYL-N,N-DIPROPYLISOPHTHALAMIDE | CHEMBL257278 | 11592145 | JWYOKBPWLVCFKU-ICYKMPLBSA-N |
| Explore | None | SI5 | (4aR,6R,8aS)-8a-(2,4-difluorophenyl)-6-(1-methyl-1H-pyrazol-4-yl)-4,4a,5,6,8,8a-hexahydropyrano[3,4-d][1,3]thiazin-2-amine | CHEMBL3422238 | 72547320 | JYDYMWJEZLKIBS-CXMBCZLWSA-N |
| Explore | None | SII | N-(4-{[4-(cyclohexylamino)-1-(3-fluorophenyl)-2-oxo-1,3,8-triazaspiro[4.5]dec-3-en-8-yl]methyl}phenyl)acetamide | CHEMBL495087 | 135875806;25023930 | VXIOVOURIXSOTD-UHFFFAOYSA-N |
| Explore | None | SKW | ~{N}-[3-[(4~{S})-2-azanyl-4-methyl-5,6-dihydro-1,3-thiazin-4-yl]phenyl]-5-bromanyl-pyridine-2-carboxamide | CHEMBL5093426 | 155903124 | FSIYTVBWWROBPT-KRWDZBQOSA-N |
| Explore | None | SL8 | ~{N}-[3-[(3~{R},6~{R})-5-azanyl-3,6-dimethyl-6-(trifluoromethyl)-2~{H}-1,4-oxazin-3-yl]phenyl]-5-bromanyl-pyridine-2-carboxamide | CHEMBL3653399 | 50914981 | YGNDEESWZOXXLA-ZWKOTPCHSA-N |
| Explore | None | SLK | ~{N}-[3-[(3~{R},6~{R})-5-azanyl-3,6-dimethyl-6-(trifluoromethyl)-2~{H}-1,4-oxazin-3-yl]-4-fluoranyl-phenyl]-5-cyano-3-methyl-pyridine-2-carboxamide | CHEMBL3261067 | 66665322 | BQFHTVUWPJXLOW-VQTJNVASSA-N |
| Explore | None | U64 | 6-[(Z)-2-{3-[(1S,5S,6S)-3-amino-5-methyl-1-(morpholine-4-carbonyl)-2-thia-4-azabicyclo[4.1.0]hept-3-en-5-yl]-4-fluorophenyl}-1-fluoroethenyl]pyridine-3-carbonitrile | CHEMBL4760458 | 126557115 | VZHFJCNPAIRJSA-MYMUPAQMSA-N |
| Explore | None | VG0 | N-{(1S,2R)-1-benzyl-2-hydroxy-3-[(1,1,5-trimethylhexyl)amino]propyl}-3-(ethylamino)-5-(2-oxopyrrolidin-1-yl)benzamide | CHEMBL252458 | 23657802 | BNTVCVCCNARYIP-URLMMPGGSA-N |
| Explore | None | VG3 | N-[(1S,2R)-1-benzyl-3-{[(1S)-2-(cyclohexylamino)-1-methyl-2-oxoethyl]amino}-2-hydroxypropyl]-3-(pentylsulfonyl)benzamide | CHEMBL402305 | 23657804 | FBMGVFBNGKNQCB-WTWMYVDVSA-N |
| Explore | None | VG4 | N-[(1S,2R)-1-benzyl-3-{[(1S)-2-(cyclohexylamino)-1-methyl-2-oxoethyl]amino}-2-hydroxypropyl]-3-(2-oxo-2,3-dihydro-1H-pyrrol-1-yl)-5-propoxybenzamide | None | 49867818 | OCMGZBXBWVXWRJ-KEPSJGTLSA-N |
| Explore | None | VG5 | N-[(1S,2R)-1-benzyl-3-{[(1S)-2-(cyclohexylamino)-1-methyl-2-oxoethyl]amino}-2-hydroxypropyl]-3-(ethylamino)-5-(2-oxopyrrolidin-1-yl)benzamide | CHEMBL251862 | 24882338 | ARWMRRUIIHCDKG-PWUSVURUSA-N |
| Explore | None | VG6 | N-[(1S,2R)-1-benzyl-2-hydroxy-3-{[3-(trifluoromethyl)benzyl]amino}propyl]-3-(ethylamino)-5-(2-oxopyrrolidin-1-yl)benzamide | CHEMBL403429 | 10008157 | QPGDTFHILHXFBQ-WUFINQPMSA-N |
| Explore | None | VG7 | N-[(1S,2R)-1-benzyl-3-(cyclohexylamino)-2-hydroxypropyl]-3-(ethylamino)-5-(2-oxopyrrolidin-1-yl)benzamide | CHEMBL252057 | 9983140 | PVDHVIVUNLQJLY-RRPNLBNLSA-N |
| Explore | None | VSI | N-{N-[4-(acetylamino)-3,5-dichlorobenzyl]carbamimidoyl}-2-(6-cyano-1H-indol-1-yl)acetamide | CHEMBL5270666 | 71777705 | QNSBKNRQYCQXMO-UHFFFAOYSA-N |
| Explore | None | VTI | N-{N-[4-(acetylamino)-3,5-dichlorobenzyl]carbamimidoyl}-2-(1H-indol-1-yl)acetamide | None | 71777706 | PTYGSLKLIDGJBA-UHFFFAOYSA-N |
| Explore | None | WM9 | (2S)-2-[3-(3-chlorophenyl)phenyl]-2-methyl-5,6-dihydro-1,3-oxazin-4-amine | None | 71576786 | DAWFJSNCVYTRMO-KRWDZBQOSA-N |
| Explore | None | WZV | 5-(2,2,2-Trifluoro-ethoxy)-pyridine-2-carboxylic acid [3-((S)-2-amino-1,4-dimethyl-6-oxo-1,4,5,6-tetrahydro-pyrimidin-4-yl)-phenyl]-amide | None | 49819211 | ZJFIBYCNZHIVEL-IBGZPJMESA-N |
| Explore | None | X17 | (5S)-2-amino-5-(4-methoxy-3-methylphenyl)-3-methyl-5-[(3S,5S,7S)-tricyclo[3.3.1.1~3,7~]dec-1-yl]-3,5-dihydro-4H-imidazol-4-one | None | n/a | HZIOSWLCMNAEBB-HJBSZYCQSA-N |
| Explore | None | X45 | (5S)-2-amino-5-(4-methoxy-3-methylphenyl)-3-methyl-5-(3-pyridin-3-ylphenyl)-3,5-dihydro-4H-imidazol-4-one | CHEMBL1236759 | 49867832 | TWVGNKMRZLBNOD-QHCPKHFHSA-N |
| Explore | None | XFI | N-((1S,2R)-3-(((1S)-2-(CYCLOHEXYLAMINO)-1-METHYL-2-OXOETHYL)AMINO)-2-HYDROXY-1-( PHENYLMETHYL)PROPYL)-3-((METHYLSULFONYL)(PHENYL)AMINO) BENZAMIDE | CHEMBL1210329 | 10416248 | PSSKPAZTPVDDNS-RJSONGRPSA-N |
| Explore | None | XK0 | (4S)-4-(4-methoxyphenyl)-4-methyl-5,6-dihydro-1,3-thiazin-2-amine | None | 71571522 | VKHSIJFRPDEMHV-LBPRGKRZSA-N |
| Explore | None | XLI | N-acetyl-L-leucyl-N-[(4S,5S,7R)-8-(butylamino)-5-hydroxy-2,7-dimethyl-8-oxooctan-4-yl]-L-methioninamide | CHEMBL1097361 | 45259043 | PEWRQHFGBBTOMS-FFYZIMEISA-N |
| Explore | None | Z74 | N'-{(1S,2S)-1-(3,5-difluorobenzyl)-2-hydroxy-2-[(2R)-4-(phenylsulfonyl)piperazin-2-yl]ethyl}-5-methyl-N,N-dipropylbenzene-1,3-dicarboxamide | CHEMBL1097319 | 45105273 | KDRUCCZCGHVXGH-QAXCHELISA-N |
| Explore | None | Z75 | N'-[(1S,2S)-2-[(2R)-4-benzylpiperazin-2-yl]-1-(3,5-difluorobenzyl)-2-hydroxyethyl]-5-methyl-N,N-dipropylbenzene-1,3-dicarboxamide | CHEMBL1097356 | 11707063 | ZHZSBUKNHGZRTJ-DSPMFFIESA-N |
| Explore | None | Z76 | N-[(1S,2S)-1-(3,5-difluorobenzyl)-2-hydroxy-2-{(2R)-4-[(3-methylphenyl)sulfonyl]piperazin-2-yl}ethyl]-3-{[(2R)-2-(methoxymethyl)pyrrolidin-1-yl]carbonyl}-5-methylbenzamide | CHEMBL1097342 | 45105274 | CQQMWBPWYUPVOC-PPESYSCFSA-N |
| Explore | None | Z81 | (5S)-2-amino-5-(2',5'-difluorobiphenyl-3-yl)-3-methyl-5-pyridin-4-yl-3,5-dihydro-4H-imidazol-4-one | CHEMBL1092788 | 46830239 | RKYFABJLGJZOBA-OAQYLSRUSA-N |
| Explore | None | ZN | ZINC ION | CHEMBL1236970 | 32051 | PTFCDOFLOPIGGS-UHFFFAOYSA-N |
| Explore | None | ZOO | (5R)-2-amino-5-[4-(difluoromethoxy)phenyl]-5-[4-fluoro-3-(5-fluoropent-1-yn-1-yl)phenyl]-3-methyl-3,5-dihydro-4H-imidazol-4-one | CHEMBL1270835 | 52948140 | ZSIZOKHLIKKQIV-JOCHJYFZSA-N |
| Explore | None | ZPQ | N~2~-[(2R,4S,5S)-5-{[N-{[(3,5-DIMETHYL-1H-PYRAZOL-1-YL)METHOXY]CARBONYL}-3-(METHYLSULFONYL)-L-ALANYL]AMINO}-4-HYDROXY-2,7-DIMETHYLOCTANOYL]-N-ISOBUTYL-L-VALINAMIDE | CHEMBL448008 | 6540293 | OFAZWNGNAATRSH-GWCXRDAXSA-N |
| Explore | None | ZPX | N-[(1R)-1-(4-fluorophenyl)ethyl]-N'-[(2S,3S)-3-hydroxy-1-phenyl-4-(1H-pyrazol-1-yl)butan-2-yl]-5-[methyl(methylsulfonyl)amino]benzene-1,3-dicarboxamide | None | 66575070 | YTBFVFURRJQMRL-AUDJAPFVSA-N |
| Explore | None | ZPY | ethyl 1-{(2S,3S)-3-[(3-{[(1R)-1-(4-fluorophenyl)ethyl]carbamoyl}-5-[methyl(methylsulfonyl)amino]benzoyl)amino]-2-hydroxy-4-phenylbutyl}-1H-pyrazole-4-carboxylate | None | 66575071 | MTFQLBNDNYIGHD-OJXBSAKDSA-N |
| Explore | None | ZPZ | N-[(1R)-1-(4-fluorophenyl)ethyl]-N'-[(2S,3S)-3-hydroxy-4-{4-[(1S)-1-hydroxyethyl]-1H-1,2,3-triazol-1-yl}-1-phenylbutan-2-yl]-5-[methyl(methylsulfonyl)amino]benzene-1,3-dicarboxamide | None | 66575072 | CUYAHRWSXUTTQB-PELBXYKSSA-N |
| Explore | None | ZQS | (4aR,7aR)-6-(pyrimidin-2-yl)-7a-(thiophen-2-yl)-4,4a,5,6,7,7a-hexahydropyrrolo[3,4-d][1,3]thiazin-2-amine | CHEMBL5095827 | 78318700 | GFWNXZDRVLVYFN-HZMBPMFUSA-N |
| Explore | None | ZR7 | N-{3-[(4aR,7aS)-2-amino-6-(5-fluoropyrimidin-2-yl)-4a,5,6,7-tetrahydropyrrolo[3,4-d][1,3]thiazin-7a(4H)-yl]-4-fluorophenyl}-5-methoxypyrazine-2-carboxamide | CHEMBL4452566 | 78210254 | VQSRKMNBWMHJKY-YTEVENLXSA-N |
| Explore | None | ZRD | (4aR,7aR)-6-(5-fluoropyrimidin-2-yl)-7a-(1,2-thiazol-5-yl)-4,4a,5,6,7,7a-hexahydropyrrolo[3,4-d][1,3]thiazin-2-amine | CHEMBL3704998 | 71738999 | JTNSTOMSFFQQFP-SDBXPKJASA-N |
| Explore | None | ZY0 | N-[(1S,2R)-1-BENZYL-2-HYDROXY-3-{[3-(TRIFLUOROMETHYL)BENZYL]AMINO}PROPYL]-4-ETHYL-8-(2-OXOPYRROLIDIN-1-YL)QUINOLINE-6-CARBOXAMIDE | CHEMBL501958 | 44143269 | YDNCUOPJVVQEMT-MFMCTBQISA-N |
| Explore | None | ZY1 | N-{(1S,2R)-1-benzyl-2-hydroxy-3-[(3-methoxybenzyl)amino]propyl}-7-ethyl-1-methyl-3,4-dihydro-1H-[1,2,5]thiadiazepino[3,4,5-hi]indole-9-carboxamide 2,2-dioxide | CHEMBL539436 | 9938431 | MNGUVHPNHVMEDL-MFMCTBQISA-N |
| Explore | None | ZY2 | N-{(1S,2R)-1-BENZYL-2-HYDROXY-3-[(3-METHOXYBENZYL)AMINO]PROPYL}-8-ETHYL-1-METHYL-3,4,7,8-TETRAHYDRO-1H,6H-[1,2,5]THIADIAZEPINO[5,4,3-DE]QUINOXALINE-10-CARBOXAMIDE 2,2-DIOXIDE | None | 49867919 | UKAHVQYVCSVAKY-BHBYDHKZSA-N |
| Explore | None | ZY3 | N-{(1S,2R)-1-BENZYL-2-HYDROXY-3-[(3-METHOXYBENZYL)AMINO]PROPYL}-6-(ETHYLAMINO)-1-METHYL-1,3,4,5-TETRAHYDRO-2,1-BENZOTHIAZEPINE-8-CARBOXAMIDE 2,2-DIOXIDE | None | 25271562 | JAQQVYMOVUUAHB-MFMCTBQISA-N |
| Explore | None | ZY4 | N-[(1S)-1-BENZYL-2,2-DIHYDROXY-3-(TETRAHYDRO-2H-PYRAN-4-YLAMINO)PROPYL]-6-ETHYL-1-METHYL-1,3,4,6-TETRAHYDRO[1,2]THIAZEPINO[5,4,3-CD]INDOLE-8-CARBOXAMIDE 2,2-DIOXIDE | None | 49867920 | LMEDJLLRHRUTJN-SANMLTNESA-N |
| Explore | None | ZYE | N-{(1S,2R)-1-BENZYL-2-HYDROXY-3-[(3-METHOXYBENZYL)AMINO]PROPYL}-1-ETHYL-4-(2-OXOPYRROLIDIN-1-YL)-1H-INDOLE-6-CARBOXAMIDE | CHEMBL529838 | 44526776 | BARAICYUEPEIRD-QCENPCRXSA-N |