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PDB Ligand Accession

Browse small molecules by PDB ligand accession and use Explore to open matching proteins.

37373 molecules found
DrugDomain DataDrugBank IDPDB LigandLigand NameKingdomSuperclassClassSubclass
ExploreDB068420MO(4R)-4-(3-butoxy-4-methoxybenzyl)imidazolidin-2-oneOrganic compoundsBenzenoidsPhenol ethersAnisoles
Exploren/a0MPN-((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)acetamideOrganic compoundsBenzenoidsBenzene and substituted derivativesPhenylbutylamines
Exploren/a0MQ[2-(cyclohexylamino)ethane-1,1-diyl]bisphosphonic acidOrganic compoundsOrganic acids and derivativesOrganic phosphonic acids and derivativesBisphosphonates
Exploren/a0MRN-[4-chloranyl-5-[4-[[3-(2-methoxyphenyl)-5-methyl-1,2-oxazol-4-yl]carbonyl]piperazin-1-yl]-2-nitro-phenyl]pyridine-2-carboxamideOrganic compoundsBenzenoidsBenzene and substituted derivativesAnilides
Exploren/a0MS[4-(5-bromanyl-3-methyl-pyridin-2-yl)piperazin-1-yl]-[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]methanoneOrganic compoundsOrganoheterocyclic compoundsDiazinanesPiperazines
Exploren/a0MT4-[(4R)-4-(4-nitrophenyl)-6-oxidanylidene-3-phenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-5-yl]benzoic acidOrganic compoundsOrganoheterocyclic compoundsAzolesPyrazoles
Exploren/a0MU(2R)-5-(acetyloxymethyl)-2-[(1R)-1-[[(5R)-5-azanyl-6-oxidanyl-6-oxidanylidene-hexanoyl]amino]-2-oxidanylidene-ethyl]-5,6-dihydro-2H-1,3-thiazine-4-carboxylic acidn/an/an/an/a
Exploren/a0MV(3S)-3-(1H-indol-3-ylmethyl)-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dioneOrganic compoundsOrganoheterocyclic compoundsBenzodiazepines1,4-benzodiazepines
Exploren/a0MW[2-(hexylamino)ethane-1,1-diyl]bis(phosphonic acid)Organic compoundsOrganic acids and derivativesOrganic phosphonic acids and derivativesBisphosphonates
Exploren/a0MXN-[5-(4-{[(3-chlorophenyl)sulfonyl]amino}phenyl)-1H-indazol-3-yl]furan-2-carboxamideOrganic compoundsBenzenoidsBenzene and substituted derivativesSulfanilides
Exploren/a0MYN-[4-(3-amino-1H-indazol-5-yl)phenyl]-3-chlorobenzenesulfonamideOrganic compoundsBenzenoidsBenzene and substituted derivativesSulfanilides
Exploren/a0MZ2-{(2Z,5S)-4-hydroxy-2-[(2E)-(2-hydroxybenzylidene)hydrazinylidene]-2,5-dihydro-1,3-thiazol-5-yl}-N-[3-(trifluoromethyl)phenyl]acetamideOrganic compoundsBenzenoidsBenzene and substituted derivativesTrifluoromethylbenzenes
Exploren/a0N0(3S,5R)-N-{[9-(4-methoxybutyl)-9H-xanthen-9-yl]methyl}-5-{[(4-methylphenyl)sulfonyl]amino}piperidine-3-carboxamideOrganic compoundsOrganoheterocyclic compoundsBenzopyrans1-benzopyrans
Exploren/a0N1(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-dioneOrganic compoundsPhenylpropanoids and polyketidesMacrolactamsn/a
Exploren/a0N2(2R,4S,5R,6R)-4-amino-5-hydroxy-6-methyltetrahydro-2H-pyran-2-yl [(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)tetrahydrofuran-2-yl]methyl dihydrogen diphosphateOrganic compoundsNucleosides, nucleotides, and analoguesPyrimidine nucleotidesPyrimidine nucleotide sugars
Exploren/a0N33-({[(dihydroxyboranyl)methyl]sulfamoyl}methyl)benzoic acidOrganic compoundsBenzenoidsBenzene and substituted derivativesBenzoic acids and derivatives
Exploren/a0N4[({[4-(1H-tetrazol-5-yl)phenyl]sulfonyl}amino)methyl]boronic acidOrganic compoundsOrganoheterocyclic compoundsAzolesTetrazoles
Exploren/a0N5N-{4-[(7-hydroxy-6-methoxyquinazolin-4-yl)amino]phenyl}benzamideOrganic compoundsBenzenoidsBenzene and substituted derivativesAnilides
Exploren/a0N6(R)-(3-(3-cyanophenyl)-1-oxo-1-(pyrrolidin-1-yl)propan-2-yl)-1,2,3,4-tetrahydroisoquinoline-6-sulfonamideOrganic compoundsOrganic acids and derivativesCarboxylic acids and derivativesAmino acids, peptides, and analogues
Exploren/a0N72-hydroxyisoquinoline-1,3(2H,4H)-dioneOrganic compoundsOrganoheterocyclic compoundsIsoquinolines and derivatives1,3-isoquinolinediones
Exploren/a0N8(2Z)-4-[1-benzyl-4-(4-chlorobenzyl)piperidin-4-yl]-2-hydroxy-4-oxobut-2-enoic acidOrganic compoundsOrganoheterocyclic compoundsPiperidinesBenzylpiperidines
Exploren/a0N95-hydroxy-2-(1-methyl-1H-imidazol-4-yl)-6-oxo-1,6-dihydropyrimidine-4-carboxylic acidOrganic compoundsOrganoheterocyclic compoundsDiazinesPyrimidines and pyrimidine derivatives
Exploren/a0NA[({[6-(1H-tetrazol-5-yl)pyridin-3-yl]sulfonyl}amino)methyl]boronic acidOrganic compoundsOrganoheterocyclic compoundsPyridines and derivativesPyridinesulfonamides
Exploren/a0NB[({[3-chloro-4-(1H-tetrazol-5-yl)phenyl]sulfonyl}amino)methyl]boronic acidOrganic compoundsOrganoheterocyclic compoundsAzolesTetrazoles
Exploren/a0ND[({[2-chloro-4-(1H-tetrazol-5-yl)phenyl]sulfonyl}amino)methyl]boronic acidOrganic compoundsOrganoheterocyclic compoundsAzolesTetrazoles
Exploren/a0NE[({[4-(1H-tetrazol-5-yl)-2-(trifluoromethyl)phenyl]sulfonyl}amino)methyl]boronic acidOrganic compoundsOrganoheterocyclic compoundsAzolesTetrazoles
Exploren/a0NF(2S)-N-[3-(2-aminopropan-2-yl)-5-(trifluoromethyl)phenyl]-7-[(7-oxo-5,6,7,8-tetrahydro-1,8-naphthyridin-4-yl)oxy]-1,2,3,4-tetrahydronaphthalene-2-carboxamideOrganic compoundsBenzenoidsNaphthalenesNaphthalenecarboxylic acids and derivatives
Exploren/a0NG({[(chloromethyl)sulfonyl]amino}methyl)boronic acidOrganic compoundsOrganic acids and derivativesOrganic sulfonic acids and derivativesOrganosulfonic acids and derivatives
Exploren/a0NH1-[4-methyl-1-(methylsulfonyl)piperidin-4-yl]-1,6-dihydroimidazo[4,5-d]pyrrolo[2,3-b]pyridineOrganic compoundsOrganoheterocyclic compoundsPyrrolopyridinesn/a
Exploren/a0NIAurachin Dn/an/an/an/a
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