TTD_Target_ID Target_Name TTD_Drug_ID Drug_Name Drug_Highest_Status Drug_PubchemID Molecular_Formula Molecular_Weight Canonical_SMILES Activity Binder_Type T89360 Inosine-5'-monophosphate dehydrogenase 2 D06IAR Adenosine Approved 60961 C10H13N5O4 267.24 C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)N Ki ~ 100000 nM Poor binder T89360 Inosine-5'-monophosphate dehydrogenase 2 B0HBE5 (E)-6-(4-Hydroxy-6-methoxy-2,7-dimethyl-3-oxo-2,3-dihydro-1H-isoindol-5-yl)-4-methyl-hex-4-enoic acid Investigative 10759053 C18H23NO5 333.4 CC1=C2CN(C(=O)C2=C(C(=C1OC)C/C=C(\\C)/CCC(=O)O)O)C IC50 ~ 100000 nM Poor binder T89360 Inosine-5'-monophosphate dehydrogenase 2 B1R7CB (E)-6-(6-Hydroxy-2-methoxy-3,4-dimethyl-phenyl)-4-methyl-hex-4-enoic Acid Investigative 10492850 C16H22O4 278.34 CC1=CC(=C(C(=C1C)OC)C/C=C(\\C)/CCC(=O)O)O IC50 = 51800 nM Poor binder T89360 Inosine-5'-monophosphate dehydrogenase 2 B26LVE (E)-6-(5-Hydroxy-2-methoxy-3,4-dimethyl-phenyl)-4-methyl-hex-4-enoic Acid Investigative 10826452 C16H22O4 278.34 CC1=C(C=C(C(=C1C)OC)C/C=C(\\C)/CCC(=O)O)O IC50 ~ 100000 nM Poor binder T89360 Inosine-5'-monophosphate dehydrogenase 2 B27GIR Adenosine 5''-methylenebis(sulfonamide) Investigative 44578789 C11H17N7O7S2 423.4 C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)CNS(=O)(=O)CS(=O)(=O)N)O)O)N Ki ~ 100000 nM Poor binder T89360 Inosine-5'-monophosphate dehydrogenase 2 B3AF8U (E)-6-(2,5-Dimethoxy-3,4-dimethyl-phenyl)-4-methyl-hex-4-enoic Acid Investigative 10685057 C17H24O4 292.4 CC1=C(C=C(C(=C1C)OC)C/C=C(\\C)/CCC(=O)O)OC IC50 = 50000 nM Poor binder T89360 Inosine-5'-monophosphate dehydrogenase 2 B4C3LG N-(4-Chlorophenyl)-2-phenoxypropanamide Investigative 3140491 C15H14ClNO2 275.73 CC(C(=O)NC1=CC=C(C=C1)Cl)OC2=CC=CC=C2 EC50 ~ 50000 nM Poor binder T89360 Inosine-5'-monophosphate dehydrogenase 2 B4DF3G 6-(2-Methoxy-3,4-dimethyl-5-methylsulfenyloxy-phenyl)-4-methyl-hex-4-enoic acid Investigative 44354730 C17H24O4S 324.4 CC1=C(C=C(C(=C1C)OC)C/C=C(\\C)/CCC(=O)O)OSC IC50 ~ 100000 nM Poor binder T89360 Inosine-5'-monophosphate dehydrogenase 2 B4FW1T 7-(Benzo[d]oxazol-2-ylamino)-1-methyl-1H-indole-3-carbonitrile Investigative 44410732 C17H12N4O 288.3 CN1C=C(C2=C1C(=CC=C2)NC3=NC4=CC=CC=C4O3)C#N IC50 = 58400 nM Poor binder T89360 Inosine-5'-monophosphate dehydrogenase 2 B4SFE0 (E)-6-[2-Hydroxy-6-methoxy-3-(methoxyimino-methyl)-4,5-dimethyl-phenyl]-4-methyl-hex-4-enoic acid Investigative 135419254 C18H25NO5 335.4 CC1=C(C(=C(C(=C1/C=N/OC)O)C/C=C(\\C)/CCC(=O)O)OC)C IC50 = 52800 nM Poor binder T89360 Inosine-5'-monophosphate dehydrogenase 2 B8YCX5 6-(Benzyloxy)-1H-indole-3-carbonitrile Investigative 44410469 C16H12N2O 248.28 C1=CC=C(C=C1)COC2=CC3=C(C=C2)C(=CN3)C#N IC50 = 71800 nM Poor binder T89360 Inosine-5'-monophosphate dehydrogenase 2 B9BN1T 2-[5-O-[(5'-Adenylyloxy)phosphonyl]-beta-D-ribofuranosyl]-4-carbamoylfuran Investigative 10841975 C20H26N6O15P2 652.4 C1=C(OC=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O Ki = 57900 nM Poor binder T89360 Inosine-5'-monophosphate dehydrogenase 2 B9CW6B (E)-6-(7-Carbamoyl-4-hydroxy-6-methoxy-3-oxo-1,3-dihydro-isobenzofuran-5-yl)-4-methyl-hex-4-enoic acid Investigative 10593915 C17H19NO7 349.3 C/C(=C\\CC1=C(C2=C(COC2=O)C(=C1OC)C(=O)N)O)/CCC(=O)O IC50 ~ 100000 nM Poor binder T89360 Inosine-5'-monophosphate dehydrogenase 2 BD1YJ8 (E)-6-(2-Methoxy-3,4-dimethyl-5-methylsulfanyl-phenyl)-4-methyl-hex-4-enoic Acid Investigative 10709955 C17H24O3S 308.4 CC1=C(C=C(C(=C1C)OC)C/C=C(\\C)/CCC(=O)O)SC IC50 = 52300 nM Poor binder T89360 Inosine-5'-monophosphate dehydrogenase 2 BH0F3L [(2S,3R,4S)-3,4-Dihydroxy-5-[2-(hydroxymethyl)-6-oxo-1H-purin-9-yl]oxolan-2-yl]methyl dihydrogen phosphate Investigative 135976471 C11H15N4O9P 378.23 C1=NC2=C(N1C3[C@H]([C@H]([C@@H](O3)COP(=O)(O)O)O)O)N=C(NC2=O)CO IC50 = 132000 nM Poor binder T89360 Inosine-5'-monophosphate dehydrogenase 2 BNB62G 6-(2,4-Dimethoxy-3-methyl-5-(oxazol-5-yl)phenyl)-4-methylhex-4-enoic acid Investigative 44589785 C19H23NO5 345.4 CC1=C(C(=CC(=C1OC)C2=CN=CO2)C/C=C(\\C)/CCC(=O)O)OC Ki ~ 100000 nM Poor binder T89360 Inosine-5'-monophosphate dehydrogenase 2 BRT6X9 (4E)-6-(4,6-Dimethoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methylhex-4-enoic acid Investigative 44433349 C18H22O6 334.4 CC1=C2COC(=O)C2=C(C(=C1OC)C/C=C(\\C)/CCC(=O)O)OC IC50 = 72000 nM Poor binder T89360 Inosine-5'-monophosphate dehydrogenase 2 BU6AS5 N-(4-Methoxyphenyl)-2-(2-thiazol-4-ylbenzimidazol-1-yl)acetamide Investigative 6618978 C19H16N4O2S 364.4 COC1=CC=C(C=C1)NC(=O)CN2C3=CC=CC=C3N=C2C4=CSC=N4 IC50 ~ 50000 nM Poor binder T89360 Inosine-5'-monophosphate dehydrogenase 2 BWI21J Penicacid C Investigative 59053798 C17H22O9 370.4 CC1=C2COC(=O)C2=C(C(=C1OC)CC(C(C)(C(CC(=O)O)O)O)O)O IC50 = 73240 nM Poor binder T89360 Inosine-5'-monophosphate dehydrogenase 2 BXP79E (E)-6-(6-Hydroxy-2,3,4-trimethyl-phenyl)-4-methyl-hex-4-enoic Acid Investigative 10515627 C16H22O3 262.34 CC1=CC(=C(C(=C1C)C)C/C=C(\\C)/CCC(=O)O)O IC50 ~ 100000 nM Poor binder T89360 Inosine-5'-monophosphate dehydrogenase 2 BXQ97I (E)-6-(6-Amino-2,3,4-trimethyl-phenyl)-4-methyl-hex-4-enoic Acid Investigative 10682843 C16H23NO2 261.36 CC1=CC(=C(C(=C1C)C)C/C=C(\\C)/CCC(=O)O)N IC50 = 90800 nM Poor binder T89360 Inosine-5'-monophosphate dehydrogenase 2 BY53XA [(2S,3S,4R,5S)-5-(6-Aminopurin-9-yl)-4-fluoro-3-hydroxyoxolan-2-yl]methoxy-[[[(2R,3S,4R,5S)-5-(3-carbamoylphenyl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]methyl]phosphinic acid Investigative 90663712 C23H29FN6O12P2 662.5 C1=CC(=CC(=C1)C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(CP(=O)(O)OC[C@H]3[C@@H]([C@H]([C@H](O3)N4C=NC5=C(N=CN=C54)N)F)O)O)O)O IC50 = 175000 nM Poor binder T89360 Inosine-5'-monophosphate dehydrogenase 2 BY8BN4 (E)-6-(7-Cyano-4-hydroxy-6-methoxy-3-oxo-1,3-dihydro-isobenzofuran-5-yl)-4-methyl-hex-4-enoic acid Investigative 10687933 C17H17NO6 331.32 C/C(=C\\CC1=C(C(=C2COC(=O)C2=C1O)C#N)OC)/CCC(=O)O IC50 ~ 100000 nM Poor binder