TTD_Target_ID Target_Name TTD_Drug_ID Drug_Name Drug_Highest_Status Drug_PubchemID Molecular_Formula Molecular_Weight Canonical_SMILES Activity Binder_Type T06273 Poly [ADP-ribose] polymerase 1 B0FCK2 CID 66716841 Investigative 66716841 C23H27ClN4O3 442.9 CCNC(=O)C1=CC(=C(C=C1)N2CCN(CC2)CC3=CC4=C(C=C3)OC(C(=O)N4)C)Cl EC50 = 100000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 B0MK9O 4-(4-Carbamoylphenoxy)benzamide Investigative 236501 C14H12N2O3 256.26 C1=CC(=CC=C1C(=O)N)OC2=CC=C(C=C2)C(=O)N IC50 ~ 100000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 B0NCM2 Chembl4290954 Investigative 121398248 C21H24N4O4S2 460.6 CC1=NC=C(S1)CN2C(=O)C3=C(C=CC(=C3)S(=O)(=O)NC4(CC4)C)N(C2=O)CC5CC5 EC50 ~ 150000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 B0P4AJ 5-(Adamantan-1-ylcarboxamido)isoquinolin-1-one Investigative 52936896 C20H22N2O2 322.4 C1C2CC3CC1CC(C2)(C3)C(=O)NC4=CC=CC5=C4C=CNC5=O IC50 ~ 50000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 B0R7CZ IWR-1-endo Investigative 44483163 C25H19N3O3 409.4 C1[C@@H]2C=C[C@H]1[C@@H]3[C@H]2C(=O)N(C3=O)C4=CC=C(C=C4)C(=O)NC5=CC=CC6=C5N=CC=C6 IC50 ~ 85000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 B13PAT CID 66716805 Investigative 66716805 C25H32N4O3 436.5 CCNC(=O)C1=CC(=C(C=C1)N2CCN(CC2)CC3=CC4=C(C(=C3)C)OC(C(=O)N4)C)C EC50 = 55000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 B1KTA9 2-Fluoro-N-(1-oxo-3,4-dihydro-2H-isoquinolin-4-yl)-5-[(4-oxo-3H-phthalazin-1-yl)methyl]benzamide Investigative 71605031 C25H19FN4O3 442.4 C1C(C2=CC=CC=C2C(=O)N1)NC(=O)C3=C(C=CC(=C3)CC4=NNC(=O)C5=CC=CC=C54)F IC50 = 86340 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 B2RYT0 CID 66716949 Investigative 66716949 C26H32N4O4 464.6 CC1C(=O)NC2=C(O1)C(=CC(=C2)CN3CCN(CC3)C4=C(C=C(C=C4)C(=O)NC5CC5)C)OC EC50 = 77000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 B3W7HN 2-Amino-5-[4-[(4S)-5,5-dimethyl-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]cyclohexyl]pyridine-3-carbonitrile Investigative 72724967 C23H26N4O2 390.5 CC1([C@@H](N(C(=O)O1)C2CCC(CC2)C3=CC(=C(N=C3)N)C#N)C4=CC=CC=C4)C IC50 ~ 85000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 B4NR6Q CID 66717219 Investigative 66717219 C24H30N4O4 438.5 CC1C(=O)NC2=C(O1)C(=CC(=C2)CN3CCN(CC3)C4=C(C=C(C=C4)C(=O)NC)C)OC EC50 = 100000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 B4OK5I 3,5-Dichloro-N-(3-chloro-4-naphthalen-2-yloxyphenyl)-2-hydroxybenzamide Investigative 53387188 C23H14Cl3NO3 458.7 C1=CC=C2C=C(C=CC2=C1)OC3=C(C=C(C=C3)NC(=O)C4=C(C(=CC(=C4)Cl)Cl)O)Cl IC50 = 120000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 B4X3EA N-[(4-Oxo-3,5,7,8-tetrahydropyrano[4,3-d]pyrimidin-2-yl)methyl]-3-phenyl-N-(thiophen-3-ylmethyl)propanamide Investigative 136232699 C22H23N3O3S 409.5 C1COCC2=C1N=C(NC2=O)CN(CC3=CSC=C3)C(=O)CCC4=CC=CC=C4 IC50 = 71000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 B50LQP (Z)-5-((1H-Indol-3-yl)methylene)thiazolidine-2,4-dione Investigative 135420896 C12H8N2O2S 244.27 C1=CC=C2C(=C1)/C(=C/C3=C(NC(=O)S3)O)/C=N2 IC50 ~ 100000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 B58HDN Chembl4293745 Investigative 121398630 C23H27N7O4S 497.6 CC1=NN(C(=C1)CN2C3=C(C=C(C=C3)S(=O)(=O)NC4(CC4)C)C(=O)N(C2=O)CC5=CN(N=C5)C)C EC50 ~ 150000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 B67FGZ 12,14-Dimethyl-9,11,17-triazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,12,14,16-heptaen-8-one Investigative 46225777 C16H13N3O 263.29 CC1=CC2=NC3=C(N2C(=C1)C)NC(=O)C4=CC=CC=C43 IC50 ~ 100000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 B69OWY 4-Fluorobenzamide Investigative 71572 C7H6FNO 139.13 C1=CC(=CC=C1C(=O)N)F IC50 = 200000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 B6CG2H 2-(4-Bromophenyl)-8-methoxy-1H-quinazolin-4-one Investigative 136491263 C15H11BrN2O2 331.16 COC1=CC=CC2=C1N=C(NC2=O)C3=CC=C(C=C3)Br IC50 ~ 100000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 B6O4GP 7-Methoxy-3,4-dihydroisoquinolin-1(2H)-one Investigative 13521672 C10H11NO2 177.2 COC1=CC2=C(CCNC2=O)C=C1 IC50 ~ 100000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 B6PHU1 3,4-Dihydroisoquinolin-1(2H)-one Investigative 150896 C9H9NO 147.17 C1CNC(=O)C2=CC=CC=C21 IC50 = 100000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 B7GZ8Q 2-[(3-Chloro-4-naphthalen-2-yloxyphenyl)carbamoyl]benzoic acid Investigative 56658117 C24H16ClNO4 417.8 C1=CC=C2C=C(C=CC2=C1)OC3=C(C=C(C=C3)NC(=O)C4=CC=CC=C4C(=O)O)Cl IC50 = 66000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 B7PZ1E 7-(Trifluoromethyl)-3,4-dihydroisoquinolin-1(2H)-one Investigative 66801593 C10H8F3NO 215.17 C1CNC(=O)C2=C1C=CC(=C2)C(F)(F)F IC50 = 100000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 B7R1BG Pratol Investigative 5320693 C16H12O4 268.26 COC1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C=C(C=C3)O IC50 ~ 100000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 B82BCA CID 66716892 Investigative 66716892 C24H30N4O3 422.5 CC1C(=O)NC2=C(O1)C(=CC(=C2)CN3CCN(CC3)C4=C(C=C(C=C4)C(=O)NC)C)C EC50 = 78000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 B82KFB 4-(4-Formyl-phenoxy)-benzamide Investigative 28825277 C14H11NO3 241.24 C1=CC(=CC=C1C=O)OC2=CC=C(C=C2)C(=O)N IC50 ~ 100000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 B84PNF N-[4-[(4S)-5,5-Dimethyl-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]cyclohexyl]-7-fluoro-1,5-naphthyridine-4-carboxamide Investigative 71681176 C26H27FN4O3 462.5 CC1([C@@H](N(C(=O)O1)C2CCC(CC2)NC(=O)C3=C4C(=NC=C3)C=C(C=N4)F)C5=CC=CC=C5)C IC50 ~ 85000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 B87AZR 5-(Cyclohexanecarboxamido)isoquinolin-1-one Investigative 52936894 C16H18N2O2 270.33 C1CCC(CC1)C(=O)NC2=CC=CC3=C2C=CNC3=O IC50 ~ 80000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 B89NGX 2-Fluoro-N-(3-oxo-1,2-dihydroinden-1-yl)-5-[(4-oxo-3H-phthalazin-1-yl)methyl]benzamide Investigative 71604870 C25H18FN3O3 427.4 C1C(C2=CC=CC=C2C1=O)NC(=O)C3=C(C=CC(=C3)CC4=NNC(=O)C5=CC=CC=C54)F IC50 = 83900 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 B8FI2J N-Cyclopropyl-4-[4-[(8-methoxy-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)methyl]piperazin-1-yl]benzamide Investigative 66716626 C25H30N4O4 450.5 CC1C(=O)NC2=C(O1)C(=CC(=C2)CN3CCN(CC3)C4=CC=C(C=C4)C(=O)NC5CC5)OC EC50 = 162000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 B8P5HN N-[4-(3-Bromonaphthalen-2-yl)oxy-3-chlorophenyl]-3,5-dichloro-2-hydroxybenzamide Investigative 56665040 C23H13BrCl3NO3 537.6 C1=CC=C2C=C(C(=CC2=C1)OC3=C(C=C(C=C3)NC(=O)C4=C(C(=CC(=C4)Cl)Cl)O)Cl)Br IC50 = 123000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 B94EWU 2-(4-Hydroxyphenyl)-1H-1,3-benzodiazole-7-carboxylic acid Investigative 135456680 C14H10N2O3 254.24 C1=CC(=C2C(=C1)NC(=N2)C3=CC=C(C=C3)O)C(=O)O Ki = 100000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 B96SDF 4-Methoxybenzamide Investigative 76959 C8H9NO2 151.16 COC1=CC=C(C=C1)C(=O)N IC50 = 57000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 B98GZX Chembl4125748 Investigative 145962722 C25H23FN2O4 434.5 C1CN(CCC1(C2=CC=C(C=C2)F)O)C(=O)C3=CC(=CC=C3)OC4=CC=C(C=C4)C(=O)N IC50 ~ 100000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 B9MVQ8 N-Cyclopropyl-4-[4-[(8-ethoxy-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)methyl]piperazin-1-yl]-3-methylbenzamide Investigative 66716876 C27H34N4O4 478.6 CCOC1=CC(=CC2=C1OC(C(=O)N2)C)CN3CCN(CC3)C4=C(C=C(C=C4)C(=O)NC5CC5)C EC50 = 100000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BB45HT 4-[4-[(8-Ethoxy-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)methyl]piperazin-1-yl]-N-ethyl-3-methylbenzamide Investigative 66716854 C26H34N4O4 466.6 CCNC(=O)C1=CC(=C(C=C1)N2CCN(CC2)CC3=CC4=C(C(=C3)OCC)OC(C(=O)N4)C)C EC50 = 100000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BBL1A6 7-Bromo-3,4-dihydroisoquinolin-1(2H)-one Investigative 25067330 C9H8BrNO 226.07 C1CNC(=O)C2=C1C=CC(=C2)Br IC50 = 100000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BC1I3X 8-Methoxy-2-[4-(Trifluoromethyl)phenyl]-3,4-Dihydroquinazolin-4-One Investigative 135513721 C16H11F3N2O2 320.27 COC1=CC=CC2=C1N=C(NC2=O)C3=CC=C(C=C3)C(F)(F)F IC50 ~ 100000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BC5J4K CID 66717080 Investigative 66717080 C24H30N4O4 438.5 CCNC(=O)C1=CC=C(C=C1)N2CCN(CC2)CC3=CC4=C(C(=C3)OC)OC(C(=O)N4)C EC50 = 151000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BCO27X N-(5,6-Dihydrothiazolo[2,3-c][1,2,4]triazol-3-yl)-3-methylbutanamide Investigative 16031314 C9H14N4OS 226.3 CC(C)CC(=O)NC1=NN=C2N1CCS2 IC50 = 55300 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BD1EV4 1,2-Dihydro-2-(4-isopropylphenyl)-4(3H)-quinazolinone Investigative 4163640 C17H18N2O 266.34 CC(C)C1=CC=C(C=C1)C2NC3=CC=CC=C3C(=O)N2 IC50 ~ 100000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BDX61C 4-[[4-Fluoro-3-(2-hydroxy-5-azatricyclo[6.3.1.04,12]dodeca-1(11),8(12),9-triene-5-carbonyl)phenyl]methyl]-2H-phthalazin-1-one Investigative 71604867 C27H22FN3O3 455.5 C1CN(C2CC(C3=CC=CC1=C23)O)C(=O)C4=C(C=CC(=C4)CC5=NNC(=O)C6=CC=CC=C65)F IC50 = 86200 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BE7B3U 6-Oxo-5,6-dihydrophenanthridine-10-carboxylic acid Investigative 12494569 C14H9NO3 239.23 C1=CC=C2C(=C1)C3=C(C=CC=C3C(=O)O)C(=O)N2 IC50 ~ 60000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BEM90P N-[3-Chloranyl-4-[[4-(4-Methoxyphenyl)oxan-4-Yl]methylcarbamoyl]phenyl]furan-2-Carboxamide Investigative 89649815 C25H25ClN2O5 468.9 COC1=CC=C(C=C1)C2(CCOCC2)CNC(=O)C3=C(C=C(C=C3)NC(=O)C4=CC=CO4)Cl IC50 ~ 100000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BEW1B3 4-[(2-Fluorophenyl)methoxy]benzamide Investigative 8607850 C14H12FNO2 245.25 C1=CC=C(C(=C1)COC2=CC=C(C=C2)C(=O)N)F IC50 ~ 100000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BG0J9S CID 66717208 Investigative 66717208 C26H32N4O3 448.6 CC1C(=O)NC2=C(O1)C(=CC(=C2)CN3CCN(CC3)C4=C(C=C(C=C4)C(=O)NC5CC5)C)C EC50 = 100000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BG25KO (4s)-3-{trans-4-[6-Amino-5-(Pyrimidin-2-Yl)pyridin-3-Yl]cyclohexyl}-5,5-Dimethyl-4-Phenyl-1,3-Oxazolidin-2-One Investigative 71660496 C26H29N5O2 443.5 CC1([C@@H](N(C(=O)O1)C2CCC(CC2)C3=CC(=C(N=C3)N)C4=NC=CC=N4)C5=CC=CC=C5)C IC50 ~ 85000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BG75NL 2-(4-Tert-Butylphenyl)-2,3-dihydroquinazoline-4(1H)-one Investigative 4826644 C18H20N2O 280.4 CC(C)(C)C1=CC=C(C=C1)C2NC3=CC=CC=C3C(=O)N2 IC50 ~ 100000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BH1TC7 2-(4-Fluorophenyl)quinazolin-4-ol Investigative 135479130 C14H9FN2O 240.23 C1=CC=C2C(=C1)C(=O)NC(=N2)C3=CC=C(C=C3)F IC50 ~ 100000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BI1O9C 4-[[3-(2,11-Diazatricyclo[7.3.1.05,13]trideca-5(13),6,8-triene-2-carbonyl)-4-fluorophenyl]methyl]-2H-phthalazin-1-one Investigative 71604716 C27H23FN4O2 454.5 C1CN(C2CNCC3=CC=CC1=C23)C(=O)C4=C(C=CC(=C4)CC5=NNC(=O)C6=CC=CC=C65)F IC50 = 156000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BI3ES5 5-(2,2-Dimethylpropanamido)isoquinolin-1-one Investigative 52936895 C14H16N2O2 244.29 CC(C)(C)C(=O)NC1=CC=CC2=C1C=CNC2=O IC50 ~ 100000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BIJ93N Chembl4290899 Investigative 121398509 C17H21N3O4S 363.4 CC1(CC1)NS(=O)(=O)C2=CC3=C(C=C2)N(C(=O)N(C3=O)C)CC4CC4 EC50 ~ 150000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BJ6XC4 Chembl4171592 Investigative 141746550 C14H12N4O 252.27 C1=CC=C(C(=C1)C2=NC3=C(C=CC=C3N2)C(=O)N)N IC50 ~ 50000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BJ93XK 4-[4-[(2,8-Dimethyl-3-oxo-4H-1,4-benzoxazin-6-yl)methyl]piperazin-1-yl]-N-ethylbenzamide Investigative 66717138 C24H30N4O3 422.5 CCNC(=O)C1=CC=C(C=C1)N2CCN(CC2)CC3=CC4=C(C(=C3)C)OC(C(=O)N4)C EC50 = 94000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BJE4Q1 N-Cyclopropyl-4-[4-[(2,8-dimethyl-3-oxo-4H-1,4-benzoxazin-6-yl)methyl]piperazin-1-yl]benzamide Investigative 46926923 C25H30N4O3 434.5 CC1C(=O)NC2=C(O1)C(=CC(=C2)CN3CCN(CC3)C4=CC=C(C=C4)C(=O)NC5CC5)C EC50 = 100000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BJER35 2-(4-Bromophenyl)-3,4-Dihydroquinazolin-4-One Investigative 135421564 C14H9BrN2O 301.14 C1=CC=C2C(=C1)C(=O)NC(=N2)C3=CC=C(C=C3)Br IC50 ~ 100000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BJY9R1 1-[4-[(4S)-5,5-Dimethyl-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]cyclohexyl]-6-fluoro-2-oxo-3H-benzimidazole-5-carbonitrile Investigative 71681329 C25H25FN4O3 448.5 CC1([C@@H](N(C(=O)O1)C2CCC(CC2)N3C4=C(C=C(C(=C4)F)C#N)NC3=O)C5=CC=CC=C5)C IC50 ~ 85000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BJZ93N 2-[4-(Trifluoromethyl)phenyl]-3h-Quinazolin-4-One Investigative 135566970 C15H9F3N2O 290.24 C1=CC=C2C(=C1)C(=O)NC(=N2)C3=CC=C(C=C3)C(F)(F)F IC50 ~ 100000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BK4H7S 3-Nitrobenzamide Investigative 12576 C7H6N2O3 166.13 C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)N IC50 = 160000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BKJ2Y6 N-(1-Oxo-3,4-dihydro-2H-isoquinolin-4-yl)-3-[(4-oxo-3H-phthalazin-1-yl)methyl]benzamide Investigative 71605032 C25H20N4O3 424.5 C1C(C2=CC=CC=C2C(=O)N1)NC(=O)C3=CC=CC(=C3)CC4=NNC(=O)C5=CC=CC=C54 IC50 = 145750 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BLUR60 7-Methyl-3,4-dihydroisoquinolin-1(2H)-one Investigative 15507355 C10H11NO 161.2 CC1=CC2=C(CCNC2=O)C=C1 IC50 = 100000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BMP1C3 3-(3-(Trifluoromethyl)phenyl)quinoline-8-carboxamide Investigative 25208597 C17H11F3N2O 316.28 C1=CC(=CC(=C1)C(F)(F)F)C2=CN=C3C(=C2)C=CC=C3C(=O)N IC50 = 52000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BOV19K 7-Fluoro-3,4-dihydroisoquinolin-1(2H)-one Investigative 17792611 C9H8FNO 165.16 C1CNC(=O)C2=C1C=CC(=C2)F IC50 = 100000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BPH98F 12-Methyl-9,11,17-triazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,12,14,16-heptaen-8-one Investigative 46225750 C15H11N3O 249.27 CC1=CC=CC2=NC3=C(N12)NC(=O)C4=CC=CC=C43 IC50 ~ 100000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BPS83V 4-[4-[(2,8-Dimethyl-3-oxo-4H-1,4-benzoxazin-6-yl)methyl]piperazin-1-yl]-N-methylbenzamide Investigative 66716783 C23H28N4O3 408.5 CC1C(=O)NC2=C(O1)C(=CC(=C2)CN3CCN(CC3)C4=CC=C(C=C4)C(=O)NC)C EC50 = 75000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BQ0PB5 (5Z)-5-[[1-[(4-Chlorophenyl)methyl]indol-3-yl]methylidene]-1,3-thiazolidine-2,4-dione Investigative 18973566 C19H13ClN2O2S 368.8 C1=CC=C2C(=C1)C(=CN2CC3=CC=C(C=C3)Cl)/C=C\\4/C(=O)NC(=O)S4 IC50 ~ 100000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BQAE41 4-[[3-(2-Amino-5-azatricyclo[6.3.1.04,12]dodeca-1(11),8(12),9-triene-5-carbonyl)-4-fluorophenyl]methyl]-2H-phthalazin-1-one Investigative 71604869 C27H23FN4O2 454.5 C1CN(C2CC(C3=CC=CC1=C23)N)C(=O)C4=C(C=CC(=C4)CC5=NNC(=O)C6=CC=CC=C65)F IC50 = 76600 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BQNJ08 3-Bromo-N-[2-(2-bromo-6-methyl-3-propan-2-ylphenoxy)-5-chlorophenyl]-5-chloro-2-hydroxybenzamide Investigative 56658116 C23H19Br2Cl2NO3 588.1 CC1=C(C(=C(C=C1)C(C)C)Br)OC2=C(C=C(C=C2)Cl)NC(=O)C3=C(C(=CC(=C3)Cl)Br)O IC50 = 78000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BS84KD 4-(4-Carbamoylphenoxy)benzoic acid Investigative 28825295 C14H11NO4 257.24 C1=CC(=CC=C1C(=O)N)OC2=CC=C(C=C2)C(=O)O IC50 ~ 100000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BS9D0K (5Z)-5-[(1-Benzylindol-3-yl)methylidene]-1,3-thiazolidine-2,4-dione Investigative 18973266 C19H14N2O2S 334.4 C1=CC=C(C=C1)CN2C=C(C3=CC=CC=C32)/C=C\\4/C(=O)NC(=O)S4 IC50 ~ 100000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BSL3C5 1-[3-[4-(2-Chlorophenyl)-5-pyrimidin-4-yl-1,2,4-triazol-3-yl]cyclobutyl]-2-oxidanylidene-3~{H}-benzimidazole-5-carbonitrile Investigative 131801402 C24H17ClN8O 468.9 C1C(CC1N2C3=C(C=C(C=C3)C#N)NC2=O)C4=NN=C(N4C5=CC=CC=C5Cl)C6=NC=NC=C6 IC50 ~ 100000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BSU1A2 3-(4-Methoxyphenyl)quinoline-8-carboxamide Investigative 25208906 C17H14N2O2 278.3 COC1=CC=C(C=C1)C2=CN=C3C(=C2)C=CC=C3C(=O)N IC50 = 62000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BT04NV 4-Amino-N-quinolin-8-ylbenzamide Investigative 6490174 C16H13N3O 263.29 C1=CC2=C(C(=C1)NC(=O)C3=CC=C(C=C3)N)N=CC=C2 IC50 ~ 100000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BT9KP0 Disodium;6-oxo-5H-phenanthridine-3,8-disulfonate Investigative 44291587 C13H7NNa2O7S2 399.3 C1=CC2=C(C=C1S(=O)(=O)[O-])C(=O)NC3=C2C=CC(=C3)S(=O)(=O)[O-].[Na+].[Na+] IC50 ~ 100000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BTBF69 Chembl4129789 Investigative 133107908 C25H23FN2O3 418.5 C1CN(CCC1C2=CC=C(C=C2)F)C(=O)C3=CC(=CC=C3)OC4=CC=C(C=C4)C(=O)N IC50 ~ 100000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BU26GV 7-Chloro-3,4-dihydroisoquinolin-1(2H)-one Investigative 18672397 C9H8ClNO 181.62 C1CNC(=O)C2=C1C=CC(=C2)Cl IC50 = 100000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BW6IR7 (4s)-3-{4-[6-Amino-5-(Pyrimidin-2-Yl)pyridin-3-Yl]phenyl}-5,5-Dimethyl-4-Phenyl-1,3-Oxazolidin-2-One Investigative 72193935 C26H23N5O2 437.5 CC1([C@@H](N(C(=O)O1)C2=CC=C(C=C2)C3=CC(=C(N=C3)N)C4=NC=CC=N4)C5=CC=CC=C5)C IC50 ~ 85000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BW7XR4 3-Bromobenzamide Investigative 89807 C7H6BrNO 200.03 C1=CC(=CC(=C1)Br)C(=O)N IC50 = 55000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BW97JI 3-(Dimethylamino)benzamide Investigative 2758498 C9H12N2O 164.2 CN(C)C1=CC=CC(=C1)C(=O)N IC50 = 120000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BWA6V5 14-Methoxy-9,11,13,17-tetrazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,12,14,16-heptaen-8-one Investigative 46225808 C14H10N4O2 266.25 COC1=CC2=NC3=C(N2C=N1)NC(=O)C4=CC=CC=C43 IC50 ~ 100000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BX6NZ3 4-[(3Ar,4r,7s,7as)-1,3-Dioxooctahydro-2h-4,7-Methanoisoindol-2-Yl]-N-(Quinolin-8-Yl)benzamide Investigative 56587957 C25H21N3O3 411.5 C1C[C@H]2C[C@@H]1[C@@H]3[C@H]2C(=O)N(C3=O)C4=CC=C(C=C4)C(=O)NC5=CC=CC6=C5N=CC=C6 IC50 ~ 100000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BY3QL6 1-[4-[(4S)-5,5-Dimethyl-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]cyclohexyl]-4-fluoro-2-oxo-3H-benzimidazole-5-carbonitrile Investigative 71681330 C25H25FN4O3 448.5 CC1([C@@H](N(C(=O)O1)C2CCC(CC2)N3C4=C(C(=C(C=C4)C#N)F)NC3=O)C5=CC=CC=C5)C IC50 ~ 85000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BYPV12 2-(4-Chlorophenyl)quinazolin-4-ol Investigative 135404247 C14H9ClN2O 256.68 C1=CC=C2C(=C1)C(=O)NC(=N2)C3=CC=C(C=C3)Cl IC50 ~ 100000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 BZQ31Y N-{4-[(2-Chlorophenyl)(Pyrimidin-4-Yl)carbamoyl]phenyl}-4-Methoxybenzamide Investigative 105539834 C25H19ClN4O3 458.9 COC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)N(C3=NC=NC=C3)C4=CC=CC=C4Cl IC50 = 77000 nM Poor binder T06273 Poly [ADP-ribose] polymerase 1 D00RIX APIGENIN Investigative 5280443 C15H10O5 270.24 C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O IC50 = 100000 nM Poor binder