TTD_Target_ID Target_Name TTD_Drug_ID Drug_Name Drug_Highest_Status Drug_PubchemID Molecular_Formula Molecular_Weight Canonical_SMILES Activity Binder_Type T83369 Coagulation factor IX B0OD4G Methyl N-[4-[2-[(1S)-1-[[(E)-3-[5-chloro-2-(tetrazol-1-yl)phenyl]prop-2-enoyl]amino]-2-phenylethyl]-1H-imidazol-5-yl]phenyl]carbamate Investigative 57976446 C29H25ClN8O3 569 COC(=O)NC1=CC=C(C=C1)C2=CN=C(N2)[C@H](CC3=CC=CC=C3)NC(=O)/C=C/C4=C(C=CC(=C4)Cl)N5C=NN=N5 Ki ~ 60000 nM Poor binder T83369 Coagulation factor IX B1NZ5J 2-Chloro-N-[2-(7-hydroxy-4-methyl-1H-benzimidazol-2-yl)ethyl]-4-(1,2,4-triazol-4-yl)benzamide Investigative 118736112 C19H17ClN6O2 396.8 CC1=C2C(=C(C=C1)O)NC(=N2)CCNC(=O)C3=C(C=C(C=C3)N4C=NN=C4)Cl Ki = 131000 nM Poor binder T83369 Coagulation factor IX B28LHJ (17S,20R)-20-(Benzylsulfonylamino)-N-[(4-carbamimidoylphenyl)methyl]-3,10,19-trioxo-2,5,8,11,18-pentazatetracyclo[20.2.2.25,8.212,15]triaconta-1(25),12,14,22(26),23,27-hexaene-17-carboxamide;2,2,2-trifluoroacetic acid Investigative 71720404 C43H48F3N9O8S 908 C1CN2CCN1CC(=O)NC3=CC=C(C[C@H](C(=O)N[C@@H](CC4=CC=C(C=C4)NC(=O)C2)C(=O)NCC5=CC=C(C=C5)C(=N)N)NS(=O)(=O)CC6=CC=CC=C6)C=C3.C(=O)(C(F)(F)F)O Ki ~ 100000 nM Poor binder T83369 Coagulation factor IX B3BU1S 2-Chloro-N-[2-(5,6-dimethyl-1H-benzimidazol-2-yl)ethyl]-4-(triazol-2-yl)benzamide Investigative 118736122 C20H19ClN6O 394.9 CC1=CC2=C(C=C1C)N=C(N2)CCNC(=O)C3=C(C=C(C=C3)N4N=CC=N4)Cl Ki ~ 145000 nM Poor binder T83369 Coagulation factor IX B3D7RA N-[2-(5,6-Dimethyl-1H-benzimidazol-2-yl)ethyl]-2-(1,2,4-triazol-4-yl)benzamide Investigative 118736113 C20H20N6O 360.4 CC1=CC2=C(C=C1C)N=C(N2)CCNC(=O)C3=CC=CC=C3N4C=NN=C4 Ki ~ 145000 nM Poor binder T83369 Coagulation factor IX B3H8WP N-[[(3S,3Ar)-1-oxo-7-(3-oxomorpholin-4-yl)-3a,4-dihydro-3H-[1,3]oxazolo[4,3-c][1,4]benzothiazin-3-yl]methyl]-5-chlorothiophene-2-carboxamide Investigative 118713018 C20H18ClN3O5S2 480 C1COCC(=O)N1C2=CC3=C(C=C2)N4[C@@H](CS3)[C@@H](OC4=O)CNC(=O)C5=CC=C(S5)Cl IC50 ~ 100000 nM Poor binder T83369 Coagulation factor IX B5VU7B N-[(1s)-1-Benzyl-2-[2-[5-Chloro-2-(Tetrazol-1-Yl)phenyl]ethylamino]-2-Oxo-Ethyl]-4-Hydroxy-2-Oxo-1h-Quinoline-6-Carboxamide Investigative 59402011 C28H24ClN7O4 558 C1=CC=C(C=C1)C[C@@H](C(=O)NCCC2=C(C=CC(=C2)Cl)N3C=NN=N3)NC(=O)C4=CC5=C(C=C4)NC(=O)C=C5O Ki ~ 73000 nM Poor binder T83369 Coagulation factor IX B6DO2F N-[2-(1H-Benzimidazol-2-yl)ethyl]-4-(1,2,4-triazol-4-yl)benzamide Investigative 118736105 C18H16N6O 332.4 C1=CC=C2C(=C1)NC(=N2)CCNC(=O)C3=CC=C(C=C3)N4C=NN=C4 Ki = 114000 nM Poor binder T83369 Coagulation factor IX B6YB2G 2-Chloro-N-[2-(5,6-dimethyl-1H-benzimidazol-2-yl)ethyl]benzamide Investigative 118736118 C18H18ClN3O 327.8 CC1=CC2=C(C=C1C)N=C(N2)CCNC(=O)C3=CC=CC=C3Cl Ki ~ 145000 nM Poor binder T83369 Coagulation factor IX B76YIG N-[2-(4-Methyl-1H-benzimidazol-2-yl)ethyl]-4-(1,2,4-triazol-4-yl)benzamide Investigative 118736110 C19H18N6O 346.4 CC1=C2C(=CC=C1)NC(=N2)CCNC(=O)C3=CC=C(C=C3)N4C=NN=C4 Ki ~ 145000 nM Poor binder T83369 Coagulation factor IX B8EXP3 2-({(1S,2S)-1-[(S)-1-(4-Carbamimidoyl-benzylcarbamoyl)-3-carbamoyl-propylcarbamoyl]-2-methyl-butylsulfamoyl}-methyl)-benzoic acid Investigative 44587263 C27H36N6O7S 588.7 CC[C@H](C)[C@@H](C(=O)N[C@@H](CCC(=O)N)C(=O)NCC1=CC=C(C=C1)C(=N)N)NS(=O)(=O)CC2=CC=CC=C2C(=O)O Ki ~ 100000 nM Poor binder T83369 Coagulation factor IX B9IR2P 4-Hydroxy-5-phenyl-1H-pyrazole-3-carboxylic acid (4-carbamimidoyl-phenyl)-amide Investigative 54726725 C17H15N5O2 321.33 C1=CC=C(C=C1)C2=NNC(=C2O)C(=O)NC3=CC=C(C=C3)C(=N)N Ki = 120000 nM Poor binder T83369 Coagulation factor IX BAMY07 N-[2-(6-Methoxy-1H-benzimidazol-2-yl)ethyl]-4-(1,2,4-triazol-4-yl)benzamide Investigative 118736109 C19H18N6O2 362.4 COC1=CC2=C(C=C1)N=C(N2)CCNC(=O)C3=CC=C(C=C3)N4C=NN=C4 Ki = 86600 nM Poor binder T83369 Coagulation factor IX BDAJ86 N-[[(3S)-1-Oxo-7-(3-oxomorpholino)-3abeta,4-dihydro-1H,3H-2,5-dioxa-9b-aza-2H-benzo[e]indene-3beta-yl]methyl]-5-chlorothiophene-2-carboxamide Investigative 76685067 C20H18ClN3O6S 463.9 C1COCC(=O)N1C2=CC3=C(C=C2)N4[C@@H](CO3)[C@@H](OC4=O)CNC(=O)C5=CC=C(S5)Cl IC50 ~ 100000 nM Poor binder T83369 Coagulation factor IX BEWX90 3-({(1S,2R)-1-[(S)-1-(4-Carbamimidoyl-benzylcarbamoyl)-3-methylsulfanyl-propylcarbamoyl]-2-hydroxy-propylsulfamoyl}-methyl)-benzoic acid Investigative 44587292 C25H33N5O7S2 579.7 C[C@H]([C@@H](C(=O)N[C@@H](CCSC)C(=O)NCC1=CC=C(C=C1)C(=N)N)NS(=O)(=O)CC2=CC(=CC=C2)C(=O)O)O Ki ~ 100000 nM Poor binder T83369 Coagulation factor IX BFC98M 3-(1H-Imidazo[4,5-c]pyridin-2-yl)-5-phenyl-1H-pyrazol-4-ol Investigative 135988780 C15H11N5O 277.28 C1=CC=C(C=C1)C2=NNC(=C2O)C3=NC4=C(N3)C=NC=C4 Ki = 110000 nM Poor binder T83369 Coagulation factor IX BFI01S 4-Cyano-N-[2-(5,6-dimethyl-1H-benzimidazol-2-yl)ethyl]-2-fluorobenzamide Investigative 118736115 C19H17FN4O 336.4 CC1=CC2=C(C=C1C)N=C(N2)CCNC(=O)C3=C(C=C(C=C3)C#N)F Ki ~ 145000 nM Poor binder T83369 Coagulation factor IX BJ98LI N-[(2S)-6-Amino-1-[5-[[4-[2-(3,4-dichlorophenyl)ethoxy]phenyl]methyl]-1,2,4-oxadiazol-3-yl]-1-oxohexan-2-yl]-3,4-difluorobenzamide;hydrochloride Investigative 45263389 C30H29Cl3F2N4O4 653.9 C1=CC(=CC=C1CC2=NC(=NO2)C(=O)[C@H](CCCCN)NC(=O)C3=CC(=C(C=C3)F)F)OCCC4=CC(=C(C=C4)Cl)Cl.Cl Ki ~ 150000 nM Poor binder T83369 Coagulation factor IX BJE9V8 2-Chloro-N-[2-(5,6-dimethyl-1H-benzimidazol-2-yl)ethyl]-4-(triazol-1-yl)benzamide Investigative 118736121 C20H19ClN6O 394.9 CC1=CC2=C(C=C1C)N=C(N2)CCNC(=O)C3=C(C=C(C=C3)N4C=CN=N4)Cl Ki = 130000 nM Poor binder T83369 Coagulation factor IX BK2SZ1 N-[2-(6-Carbamimidoyl-1H-benzimidazol-2-yl)ethyl]-4-(1,2,4-triazol-4-yl)benzamide Investigative 118736111 C19H18N8O 374.4 C1=CC(=CC=C1C(=O)NCCC2=NC3=C(N2)C=C(C=C3)C(=N)N)N4C=NN=C4 Ki = 54200 nM Poor binder T83369 Coagulation factor IX BNY76B 5-Chloro-N-(((3S,3aS)-1-oxo-7-(3-oxomorpholino)-3,3a,4,5-tetrahydro-1H-oxazolo[3,4-a]quinolin-3-yl)methyl)thiophene-2-carboxamide Investigative 118713026 C21H20ClN3O5S 461.9 C1CC2=C(C=CC(=C2)N3CCOCC3=O)N4[C@@H]1[C@@H](OC4=O)CNC(=O)C5=CC=C(S5)Cl IC50 ~ 100000 nM Poor binder T83369 Coagulation factor IX BQ5N3A 2-Chloro-N-[(2S)-1-(5,6-dimethyl-1H-benzimidazol-2-yl)propan-2-yl]-4-(1,2,4-triazol-4-yl)benzamide Investigative 118736135 C21H21ClN6O 408.9 CC1=CC2=C(C=C1C)N=C(N2)C[C@H](C)NC(=O)C3=C(C=C(C=C3)N4C=NN=C4)Cl Ki = 55400 nM Poor binder T83369 Coagulation factor IX BRK61D N-[2-(5,6-Dimethyl-1H-benzimidazol-2-yl)ethyl]-3-(1,2,4-triazol-4-yl)benzamide Investigative 118736114 C20H20N6O 360.4 CC1=CC2=C(C=C1C)N=C(N2)CCNC(=O)C3=CC(=CC=C3)N4C=NN=C4 Ki ~ 145000 nM Poor binder T83369 Coagulation factor IX BT32CJ 4-[(N-{(2e)-3-[5-Chloro-2-(1h-Tetrazol-1-Yl)phenyl]prop-2-Enoyl}-L-Phenylalanyl)amino]benzoic Acid Investigative 25166809 C26H21ClN6O4 516.9 C1=CC=C(C=C1)C[C@@H](C(=O)NC2=CC=C(C=C2)C(=O)O)NC(=O)/C=C/C3=C(C=CC(=C3)Cl)N4C=NN=N4 Ki ~ 73000 nM Poor binder T83369 Coagulation factor IX BVC8S1 N-[[(3S,3As)-1-oxo-7-(3-oxomorpholin-4-yl)-3,3a,4,5-tetrahydro-[1,3]oxazolo[3,4-a]quinoxalin-3-yl]methyl]-5-chlorothiophene-2-carboxamide Investigative 118713029 C20H19ClN4O5S 462.9 C1COCC(=O)N1C2=CC3=C(C=C2)N4[C@@H](CN3)[C@@H](OC4=O)CNC(=O)C5=CC=C(S5)Cl IC50 ~ 100000 nM Poor binder T83369 Coagulation factor IX BWXE72 Chembl4227743 Investigative 88582319 C30H24Cl2N8O3 615.5 COC(=O)NC1=CC=C(C=C1)C2=CC(=NN=C2Cl)[C@H](CC3=CC=CC=C3)NC(=O)/C=C/C4=C(C=CC(=C4)Cl)N5C=NN=N5 Ki ~ 73700 nM Poor binder