Gene name: PARP1
Protein name: Poly [ADP-ribose] polymerase
List of molecules and drugs that interact with protein P09874
| # | DrugDomain Data | PBD ligand | DrugBank Accession | PubChem | ChEMBL | Name | Drug action | Affinity data |
|---|---|---|---|---|---|---|---|---|
| 1 | P09874_09L | 09L | DB09074 | 23725625 | CHEMBL521686 | 4-(3-{[4-(cyclopropylcarbonyl)piperazin-1-yl]carbonyl}-4-fluorobenzyl)phthalazin-1(2H)-one | inhibitor | |
| 2 | P09874_15R | 15R | n/a | 78225401 | n/a | (9aR)-1-[(1-{2-fluoro-5-[(4-oxo-3,4-dihydrophthalazin-1-yl)methyl]benzoyl}piperidin-4-yl)carbonyl]-1,2,3,8,9,9a-hexahydro-7H-benzo[de][1,7]naphthyridin-7-one | n/a | |
| 3 | P09874_15S | 15S | n/a | 137347936 | n/a | N-{(2S)-1-[4-(4-fluorophenyl)-3,6-dihydropyridin-1(2H)-yl]-1-oxopropan-2-yl}-2-[(9aR)-7-oxo-2,3,7,8,9,9a-hexahydro-1H-benzo[de][1,7]naphthyridin-1-yl]acetamide | n/a | |
| 4 | P09874_1PE | 1PE | n/a | 62551 | CHEMBL1229766 | PENTAETHYLENE GLYCOL | n/a | |
| 5 | P09874_1WI | 1WI | n/a | 146659481 | CHEMBL5406119 | 1-[[4-fluoranyl-3-(3-oxidanylidene-4-pentan-3-yl-piperazin-1-yl)carbonyl-phenyl]methyl]quinazoline-2,4-dione | n/a | |
| 6 | P09874_1WQ | 1WQ | n/a | 66717023 | n/a | (2S)-6-{[4-(4-chlorophenyl)-3,6-dihydropyridin-1(2H)-yl]methyl}-2-methyl-2H-1,4-benzoxazin-3(4H)-one | n/a | |
| 7 | P09874_2UR | 2UR | n/a | 74983349 | CHEMBL3290460 | (2R)-5-fluoro-2-methyl-2,3-dihydro-1-benzofuran-7-carboxamide | n/a | |
| 8 | P09874_2US | 2US | n/a | 90644841 | CHEMBL3290477 | (2Z)-2-(2,4-dihydroxybenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-7-carboxamide | n/a | |
| 9 | P09874_2UT | 2UT | n/a | 90644847 | CHEMBL3290483 | (2Z)-2-{4-[2-(morpholin-4-yl)ethoxy]benzylidene}-3-oxo-2,3-dihydro-1-benzofuran-7-carboxamide | n/a | |
| 10 | P09874_2YQ | 2YQ | DB11760 | 135565082 | CHEMBL3137320 | (8S,9R)-5-fluoro-8-(4-fluorophenyl)-9-(1-methyl-1H-1,2,4-triazol-5-yl)-2,7,8,9-tetrahydro-3H-pyrido[4,3,2-de]phthalazin-3-one | inhibitor | |
| 11 | P09874_3GN | 3GN | n/a | 11842604 | CHEMBL497608 | 2-[(2S)-2-methylpyrrolidin-2-yl]-1H-benzimidazole-7-carboxamide | n/a | |
| 12 | P09874_3JD | 3JD | DB11793 | 24958200 | CHEMBL1094636 | 2-{4-[(3S)-piperidin-3-yl]phenyl}-2H-indazole-7-carboxamide | inhibitor | |
| 13 | P09874_4YR | 4YR | n/a | 124037116 | n/a | N-[(3R)-1-(cyclopropylmethyl)pyrrolidin-3-yl]-5-[(2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl)methyl]-2-fluorobenzamide | n/a | |
| 14 | P09874_6WX | 6WX | n/a | 122707105 | CHEMBL5427496 | 1-[[4-fluoranyl-3-(3-oxidanylidene-4-propyl-piperazin-1-yl)carbonyl-phenyl]methyl]quinazoline-2,4-dione | n/a | |
| 15 | P09874_6WY | 6WY | n/a | 122707106 | CHEMBL5413070 | 1-[[3-(4-ethyl-3-oxidanylidene-piperazin-1-yl)carbonyl-4-fluoranyl-phenyl]methyl]quinazoline-2,4-dione | n/a | |
| 16 | P09874_6WZ | 6WZ | n/a | 122391207 | CHEMBL5073596 | 1-[[4-fluoranyl-3-[(3R)-3-methyl-4-[2,2,2-tris(fluoranyl)ethyl]piperazin-1-yl]carbonyl-phenyl]methyl]quinazoline-2,4-dione | n/a | |
| 17 | P09874_6X2 | 6X2 | n/a | 122706712 | CHEMBL5087953 | 1-[[4-fluoranyl-3-[(3R)-3-methyl-4-propyl-piperazin-1-yl]carbonyl-phenyl]methyl]quinazoline-2,4-dione | n/a | |
| 18 | P09874_78P | 78P | DB07232 | 11960529 | CHEMBL506871 | (2R)-2-(7-carbamoyl-1H-benzimidazol-2-yl)-2-methylpyrrolidinium | n/a | Ki(nM) = 5.0 IC50(nM) = 1.0 Kd(nM) = 1.7 EC50(nM) = 2.0 |
| 19 | P09874_7TX | 7TX | n/a | 124037115 | n/a | 5-[[2,4-bis(oxidanylidene)quinazolin-1-yl]methyl]-2-fluoranyl-N-[(3R)-1-(3-methylbutyl)pyrrolidin-3-yl]benzamide | n/a | |
| 20 | P09874_7U3 | 7U3 | n/a | 124037117 | n/a | 7-fluoranyl-4-[[(3R)-pyrrolidin-3-yl]methoxy]-2H-phthalazin-1-one | n/a | |
| 21 | P09874_7U6 | 7U6 | n/a | 124037118 | CHEMBL4076155 | 2-piperazin-1-ylcarbonyl-1H-benzimidazole-4-carboxamide | n/a | |
| 22 | P09874_7U9 | 7U9 | n/a | 124037119 | n/a | 2-[(3R)-3-azanylpyrrolidin-1-yl]carbonyl-1H-benzimidazole-4-carboxamide | n/a | |
| 23 | P09874_7UL | 7UL | n/a | 124037120 | n/a | 1-[[4-fluoranyl-3-[4-[2,2,2-tris(fluoranyl)ethyl]piperazin-1-yl]carbonyl-phenyl]methyl]quinazoline-2,4-dione | n/a | |
| 24 | P09874_8E3 | 8E3 | n/a | 133053541 | CHEMBL4288572 | 6-fluoranyl-2-(4,5,6,7-tetrahydrofuro[2,3-c]pyridin-2-yl)-1~{H}-benzimidazole-4-carboxamide | n/a | |
| 25 | P09874_8E6 | 8E6 | n/a | 137348704 | CHEMBL4280657 | 6-fluoranyl-2-(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-yl)-1~{H}-benzimidazole-4-carboxamide | n/a | |
| 26 | P09874_8EC | 8EC | n/a | 137348705 | CHEMBL4290904 | 6-fluoranyl-2-(4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)-1~{H}-benzimidazole-4-carboxamide | n/a | |
| 27 | P09874_A92 | A92 | n/a | 46173035 | CHEMBL1089125 | 2-{2-fluoro-4-[(2S)-piperidin-2-yl]phenyl}-1H-benzimidazole-7-carboxamide | n/a | |
| 28 | P09874_AAI | AAI | DB07330 | 9925908 | CHEMBL452800 | trans-4-(7-carbamoyl-1H-benzimidazol-2-yl)-1-propylpiperidinium | inhibitor | Ki(nM) = 8.0 EC50(nM) = 3.0 |
| 29 | P09874_ACT | ACT | DB14511 | 175 | n/a | ACETATE ION | n/a | |
| 30 | P09874_CA | CA | n/a | 271 | n/a | CALCIUM ION | n/a | |
| 31 | P09874_CIT | CIT | DB04272 | 311;19782904;88113319; | CHEMBL1261 | CITRIC ACID | n/a | |
| 32 | P09874_CL | CL | n/a | 312 | n/a | CHLORIDE ION | n/a | |
| 33 | P09874_CNQ | CNQ | DB03509 | 657038 | n/a | 3-(4-CHLOROPHENYL)QUINOXALINE-5-CARBOXAMIDE | inhibitor | IC50(nM) = 33.0 |
| 34 | P09874_D7N | D7N | n/a | 49843531 | CHEMBL3606021 | 2-[1-(4,4-Difluorocyclohexyl)-piperidin-4-yl]-6-fluoro-3-oxo-2,3-dihydro-1H-isoindole-4-carboxamide | n/a | |
| 35 | P09874_DMS | DMS | DB01093 | 679 | CHEMBL504 | DIMETHYL SULFOXIDE | n/a | |
| 36 | P09874_DQV | DQV | n/a | 158378 | CHEMBL233434 | [(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl [(2R,3S,4R,5S)-5-(3-carbamoylphenyl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl dihydrogen diphosphate (non-preferred name) | n/a | |
| 37 | P09874_DS9 | DS9 | DB14769 | 135565554 | CHEMBL4112930 | (2R)-14-fluoro-2-methyl-6,9,10,19-tetrazapentacyclo[14.2.1.02,6.08,18.012,17]nonadeca-1(18),8,12(17),13,15-pentaen-11-one | n/a | |
| 38 | P09874_EDO | EDO | n/a | 174 | CHEMBL457299 | 1,2-ETHANEDIOL | n/a | |
| 39 | P09874_EOH | EOH | DB00898 | 702 | CHEMBL545 | ETHANOL | n/a | |
| 40 | P09874_EZ2 | EZ2 | n/a | 9115135;135600171; | n/a | ~{N}-[(1~{R})-1-(4-imidazol-1-ylphenyl)ethyl]-3-(4-oxidanylidene-1~{H}-quinazolin-2-yl)propanamide | n/a | |
| 41 | P09874_FRM | FRM | DB03072 | 448889;5288254;135460986; | CHEMBL401843 | 2-{3-[4-(4-FLUOROPHENYL)-3,6-DIHYDRO-1(2H)-PYRIDINYL]PROPYL}-8-METHYL-4(3H)-QUINAZOLINONE | n/a | IC50(nM) = 8.0 |
| 42 | P09874_FRQ | FRQ | DB07787 | 448890 | CHEMBL361054 | 5-FLUORO-1-[4-(4-PHENYL-3,6-DIHYDROPYRIDIN-1(2H)-YL)BUTYL]QUINAZOLINE-2,4(1H,3H)-DIONE | n/a | IC50(nM) = 60.0 |
| 43 | P09874_FSU | FSU | n/a | 20854918 | CHEMBL3605967 | 2-(3-methoxypropyl)-3-oxo-2,3-dihydro-1H-isoindole-4-carboxamide | n/a | |
| 44 | P09874_GJW | GJW | n/a | 24849157 | CHEMBL571234 | 7-(pyrrolidin-1-ylmethyl)pyrrolo[1,2-a]quinoxalin-4(5H)-one | n/a | |
| 45 | P09874_GOL | GOL | DB09462 | 753 | CHEMBL692 | GLYCEROL | n/a | |
| 46 | P09874_KYV | KYV | n/a | 138811009 | n/a | 2-({4-[4-(1H-benzimidazol-2-yl)piperazine-1-carbonyl]phenyl}methyl)-3-hydroxy-1-benzofuran-7-carboxamide | n/a | |
| 47 | P09874_L1S | L1S | n/a | 145865292 | n/a | methyl 2-{4-[4-(7-carbamoyl-1H-benzimidazol-2-yl)benzene-1-carbonyl]piperazin-1-yl}pyrimidine-5-carboxylate | n/a | |
| 48 | P09874_L3L | L3L | n/a | 24937836 | CHEMBL597890 | 3-oxo-2-piperidin-4-yl-2,3-dihydro-1H-isoindole-4-carboxamide | n/a | |
| 49 | P09874_MEW | MEW | n/a | 15674;135400457; | CHEMBL395092 | 2-methylquinazolin-4(3H)-one | n/a | |
| 50 | P09874_NA | NA | n/a | 923 | n/a | SODIUM ION | n/a | |
| 51 | P09874_NI | NI | n/a | 934 | n/a | NICKEL (II) ION | n/a | |
| 52 | P09874_O3H | O3H | n/a | 52913556;136201717; | CHEMBL4460557 | 2-[2-(4-pyridin-2-ylpiperazin-1-yl)ethylsulfanyl]-3~{H}-quinazolin-4-one | n/a | |
| 53 | P09874_P34 | P34 | DB08348 | 4858;5289097; | CHEMBL372303 | N~2~,N~2~-DIMETHYL-N~1~-(6-OXO-5,6-DIHYDROPHENANTHRIDIN-2-YL)GLYCINAMIDE | inhibitor | IC50(nM) = 9.1 Kd(nM) = 110.0 EC50(nM) = 20.0 |
| 54 | P09874_PEG | PEG | n/a | 8117 | CHEMBL1235226 | DI(HYDROXYETHYL)ETHER | n/a | |
| 55 | P09874_RPB | RPB | DB12332 | 9931954 | CHEMBL1173055 | Rucaparib | inhibitor | |
| 56 | P09874_SO4 | SO4 | DB14546 | 1117 | n/a | SULFATE ION | n/a | |
| 57 | P09874_TP0 | TP0 | DB00321 | 2160 | CHEMBL629 | Amitriptyline | n/a | IC50(nM) = 1650.0 |
| 58 | P09874_UHB | UHB | n/a | n/a | n/a | 2-[4-[(2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]carbonylpiperazin-1-yl]-N-(1-oxidanylidene-2,3-dihydroisoindol-4-yl)ethanamide | n/a | |
| 59 | P09874_VKQ | VKQ | n/a | 156596360 | CHEMBL5197101 | 5-[4-[(3-ethyl-2-oxidanylidene-1~{H}-quinolin-7-yl)methyl]piperazin-1-yl]-~{N}-methyl-pyridine-2-carboxamide | n/a | |
| 60 | P09874_VKT | VKT | n/a | 156596361 | CHEMBL5181905 | 7-[[4-(1,5-dimethylimidazol-2-yl)piperazin-1-yl]methyl]-3-ethyl-1~{H}-quinolin-2-one | n/a | |
| 61 | P09874_VKW | VKW | n/a | 156596362 | CHEMBL5193246 | 8-chloranyl-2-[3-[4-(1,5-dimethylimidazol-2-yl)piperazin-1-yl]propyl]-3~{H}-quinazolin-4-one | n/a | |
| 62 | P09874_XAV | XAV | n/a | 2726824;135418940; | CHEMBL1086580 | 2-[4-(trifluoromethyl)phenyl]-7,8-dihydro-5H-thiopyrano[4,3-d]pyrimidin-4-ol | n/a | |
| 63 | P09874_ZN | ZN | n/a | 32051 | CHEMBL1236970 | ZINC ION | n/a | |
| 64 | P09874_TEP | TEP | DB00277 | 2153 | CHEMBL190 | Theophylline | n/a | |
| 65 | P09874_DB01593 | n/a | DB01593 | n/a | n/a | Zinc | n/a | |
| 66 | P09874_CNA | CNA | DB02498 | 163884 | CHEMBL5220997 | Carba-nicotinamide-adenine-dinucleotide | inhibitor | |
| 67 | P09874_NU1 | NU1 | DB02690 | 63306;5289055;135398517; | CHEMBL123904 | NU1025 | inhibitor | Ki(nM) = 48.0 |
| 68 | P09874_NCA | NCA | DB02701 | 936 | CHEMBL1140 | Nicotinamide | binder | IC50(nM) = 50119.0 |
| 69 | P09874_3MB | 3MB | DB03073 | 98487 | CHEMBL123978 | 3-Methoxybenzamide | inhibitor | IC50(nM) = 17000.0 |
| 70 | P09874_DHQ | DHQ | DB03722 | 148140 | CHEMBL125200 | 3,4-Dihydro-5-Methyl-Isoquinolinone | inhibitor | Ki(nM) = 70.0 IC50(nM) = 150.0 |
| 71 | P09874_BZC | BZC | DB04010 | 1511 | CHEMBL134022 | 2-(3'-Methoxyphenyl) Benzimidazole-4-Carboxamide | inhibitor | Ki(nM) = 6.0 |
| 72 | P09874_4AN | 4AN | DB07096 | 1720 | CHEMBL338790 | 6-AMINO-BENZO[DE]ISOQUINOLINE-1,3-DIONE | inhibitor | IC50(nM) = 22.0 |
| 73 | P09874_33E | 33E | DB13877 | 9796068 | CHEMBL1170047 | Iniparib | n/a | |
| 74 | P09874_DB14487 | n/a | DB14487 | n/a | n/a | Zinc acetate | n/a | |
| 75 | P09874_DB14533 | n/a | DB14533 | n/a | n/a | Zinc chloride | component of |