TTD_Target_ID Target_Name TTD_Drug_ID Drug_Name Drug_Highest_Status Drug_PubchemID Molecular_Formula Molecular_Weight Canonical_SMILES Activity Binder_Type T56143 Kynurenic acid receptor D0J1VY Entacapone Approved 5281081 C14H15N3O5 305.29 CCN(CC)C(=O)/C(=C/C1=CC(=C(C(=C1)O)O)[N+](=O)[O-])/C#N EC50 = 65600 nM Poor binder T56143 Kynurenic acid receptor B0KE1H 4,6-Dinitro-O-cresol Investigative 10800 C7H6N2O5 198.13 CC1=CC(=CC(=C1O)[N+](=O)[O-])[N+](=O)[O-] EC50 = 81100 nM Poor binder T56143 Kynurenic acid receptor B39BCF 2,6-Dinitrophenol Investigative 11312 C6H4N2O5 184.11 C1=CC(=C(C(=C1)[N+](=O)[O-])O)[N+](=O)[O-] EC50 = 76000 nM Poor binder T56143 Kynurenic acid receptor B3XVK8 2,3-Dinitrophenol Investigative 6191 C6H4N2O5 184.11 C1=CC(=C(C(=C1)O)[N+](=O)[O-])[N+](=O)[O-] EC50 = 58500 nM Poor binder T56143 Kynurenic acid receptor B4UFV8 5,6-Dihydroxy-3-pyridin-3-yl-1H-indole-2-carboxylic acid Investigative 70689183 C14H10N2O4 270.24 C1=CC(=CN=C1)C2=C(NC3=CC(=C(C=C32)O)O)C(=O)O EC50 = 84000 nM Poor binder T56143 Kynurenic acid receptor B4W2HL Dithieno[3,2-b:2',3'-d]thiophene-2-carboxylic acid, 5-methyl- Investigative 16103465 C10H6O2S3 254.4 CC1=CSC2=C1SC3=C2SC(=C3)C(=O)O EC50 ~ 50000 nM Poor binder T56143 Kynurenic acid receptor B5I3NA 3-Cyclopropyl-6-methyl-4H-thieno[3,2-b]pyrrole-5-carboxylic acid Investigative 70681839 C11H11NO2S 221.28 CC1=C(NC2=C1SC=C2C3CC3)C(=O)O EC50 = 119000 nM Poor binder T56143 Kynurenic acid receptor B68CGN 5,6-Dihydroxy-1-methyl-1H-indole-2-carboxylic acid Investigative 15774807 C10H9NO4 207.18 CN1C2=CC(=C(C=C2C=C1C(=O)O)O)O EC50 = 64200 nM Poor binder T56143 Kynurenic acid receptor B7RNM5 6-Methyl-3-(1H-pyrazol-4-yl)thieno[3,2-b]thiophene-5-carboxylic acid Investigative 70686065 C11H8N2O2S2 264.3 CC1=C(SC2=C1SC=C2C3=CNN=C3)C(=O)O EC50 = 52500 nM Poor binder T56143 Kynurenic acid receptor B9NE7Q alpha-Cyano-4-hydroxycinnamic acid Investigative 5328791 C10H7NO3 189.17 C1=CC(=CC=C1/C=C(\\C#N)/C(=O)O)O EC50 = 70700 nM Poor binder T56143 Kynurenic acid receptor B9Z0JN 3-Bromo-6-methyl-4H-thieno[3,2-b]pyrrole-5-carboxylic acid Investigative 70692387 C8H6BrNO2S 260.11 CC1=C(NC2=C1SC=C2Br)C(=O)O EC50 = 113000 nM Poor binder T56143 Kynurenic acid receptor BAOX17 3-Ethynyl-6-methylthieno[3,2-b]thiophene-5-carboxylic acid Investigative 70694439 C10H6O2S2 222.3 CC1=C(SC2=C1SC=C2C#C)C(=O)O EC50 = 54800 nM Poor binder T56143 Kynurenic acid receptor BAWU69 3-Bromo-5,6-dihydroxy-1H-indole-2-carboxylic acid Investigative 70682865 C9H6BrNO4 272.05 C1=C2C(=CC(=C1O)O)NC(=C2Br)C(=O)O EC50 = 166000 nM Poor binder T56143 Kynurenic acid receptor BB0XP3 2-(3-Cyano-4,5,5-trimethylfuran-2-ylidene)propanedinitrile Investigative 9990345 C11H9N3O 199.21 CC1=C(C(=C(C#N)C#N)OC1(C)C)C#N EC50 ~ 50000 nM Poor binder T56143 Kynurenic acid receptor BBK8I4 3-(3-Carboxyphenyl)-5,6-dihydroxy-1H-indole-2-carboxylic acid Investigative 70689184 C16H11NO6 313.26 C1=CC(=CC(=C1)C(=O)O)C2=C(NC3=CC(=C(C=C32)O)O)C(=O)O EC50 = 75700 nM Poor binder T56143 Kynurenic acid receptor BEW01C Laccaic acid A Investigative 5491415 C26H19NO12 537.4 CC(=O)NCCC1=CC(=C(C=C1)O)C2=C(C3=C(C(=C2O)O)C(=O)C4=CC(=C(C(=C4C3=O)C(=O)O)C(=O)O)O)O EC50 = 51500 nM Poor binder T56143 Kynurenic acid receptor BF6S4X 5,6-Dihydroxy-3-thiophen-3-yl-1H-indole-2-carboxylic acid Investigative 70682869 C13H9NO4S 275.28 C1=CSC=C1C2=C(NC3=CC(=C(C=C32)O)O)C(=O)O EC50 = 61200 nM Poor binder T56143 Kynurenic acid receptor BFUN98 3-Bromo-6-octylthieno[3,2-b]thiophene-5-carboxylic acid Investigative 53258793 C15H19BrO2S2 375.3 CCCCCCCCC1=C(SC2=C1SC=C2Br)C(=O)O EC50 ~ 50000 nM Poor binder T56143 Kynurenic acid receptor BFVA93 (3,4-Dihydroxy-5-nitrophenyl)(2-fluorophenyl)methanone Investigative 3495594 C13H8FNO5 277.2 C1=CC=C(C(=C1)C(=O)C2=CC(=C(C(=C2)O)O)[N+](=O)[O-])F EC50 = 54400 nM Poor binder T56143 Kynurenic acid receptor BGPM30 3-Methyl-DHTCA Investigative 70684936 C10H8O4S 224.23 CC1=C(SC2=CC(=C(C=C12)O)O)C(=O)O EC50 = 90600 nM Poor binder T56143 Kynurenic acid receptor BJB1H0 4-Bromo-2-(1H-tetrazol-5-yl)aniline Investigative 10868388 C7H6BrN5 240.06 C1=CC(=C(C=C1Br)C2=NNN=N2)N IC50 = 75340 nM Poor binder T56143 Kynurenic acid receptor BKIB07 3,4-Dinitrophenol Investigative 11348 C6H4N2O5 184.11 C1=CC(=C(C=C1O)[N+](=O)[O-])[N+](=O)[O-] EC50 = 112000 nM Poor binder T56143 Kynurenic acid receptor BLGN63 5,6-Dihydroxy-3-methyl-1-benzofuran-2-carboxylic acid Investigative 45093111 C10H8O5 208.17 CC1=C(OC2=CC(=C(C=C12)O)O)C(=O)O EC50 = 133000 nM Poor binder T56143 Kynurenic acid receptor BLOR47 3-Bromo-4,6-dimethylthieno[3,2-b]pyrrole-5-carboxylic acid Investigative 70690213 C9H8BrNO2S 274.14 CC1=C(N(C2=C1SC=C2Br)C)C(=O)O EC50 = 87500 nM Poor binder T56143 Kynurenic acid receptor BN8A2M 3-Cyclopropyl-6-methylthieno[3,2-b]thiophene-5-carboxylic acid Investigative 70683939 C11H10O2S2 238.3 CC1=C(SC2=C1SC=C2C3CC3)C(=O)O EC50 = 52400 nM Poor binder T56143 Kynurenic acid receptor BO32RQ 3-Hexylthieno[3,2-b]thiophene-2-carboxylic acid Investigative 16103482 C13H16O2S2 268.4 CCCCCCC1=C(SC2=C1SC=C2)C(=O)O EC50 ~ 50000 nM Poor binder T56143 Kynurenic acid receptor BQN58S Thieno[3,2-b]thiophene-2-carboxylic acid Investigative 660319 C7H4O2S2 184.2 C1=CSC2=C1SC(=C2)C(=O)O IC50 = 57000 nM Poor binder T56143 Kynurenic acid receptor BQP2S0 3-(3,5-Difluorophenyl)-5,6-dihydroxy-1H-indole-2-carboxylic acid Investigative 70687104 C15H9F2NO4 305.23 C1=C(C=C(C=C1F)F)C2=C(NC3=CC(=C(C=C32)O)O)C(=O)O EC50 = 109000 nM Poor binder T56143 Kynurenic acid receptor BRS78Q 2-[3-Cyano-5-(2,4-difluorophenyl)-4,5-dimethylfuran-2-ylidene]propanedinitrile Investigative 21337671 C16H9F2N3O 297.26 CC1=C(C(=C(C#N)C#N)OC1(C)C2=C(C=C(C=C2)F)F)C#N EC50 = 53900 nM Poor binder T56143 Kynurenic acid receptor BSWD24 6-Hexyl-thieno[3,2-b]thiophene-2-carboxylic acid Investigative 53258899 C13H16O2S2 268.4 CCCCCCC1=CSC2=C1SC(=C2)C(=O)O EC50 ~ 50000 nM Poor binder T56143 Kynurenic acid receptor BTCB19 2-(3-Cyano-4-methyl-5-phenyl-5-(trifluoromethyl)furan-2(5H)-ylidene)malononitrile Investigative 11674067 C16H8F3N3O 315.25 CC1=C(C(=C(C#N)C#N)OC1(C2=CC=CC=C2)C(F)(F)F)C#N EC50 ~ 50000 nM Poor binder T56143 Kynurenic acid receptor BUOL64 [3-Cyano-4-methyl-1-oxaspiro[4.5]deca-3-ene-2-ylidene]malononitrile Investigative 21337669 C14H13N3O 239.27 CC1=C(C(=C(C#N)C#N)OC12CCCCC2)C#N EC50 ~ 50000 nM Poor binder T56143 Kynurenic acid receptor BYS9P4 2,5-Dinitrophenol Investigative 9492 C6H4N2O5 184.11 C1=CC(=C(C=C1[N+](=O)[O-])O)[N+](=O)[O-] EC50 = 52600 nM Poor binder T56143 Kynurenic acid receptor BZ4S3I 1-Ethyl-5,6-dihydroxyindole-2-carboxylic acid Investigative 70697498 C11H11NO4 221.21 CCN1C2=CC(=C(C=C2C=C1C(=O)O)O)O EC50 = 77100 nM Poor binder T56143 Kynurenic acid receptor D01SHB TRANSTORINE Investigative 3845 C10H7NO3 189.17 C1=CC=C2C(=C1)C(=O)C=C(N2)C(=O)O Ki = 137000 nM Poor binder T56143 Kynurenic acid receptor D09AYR 3,5-Dinitrocatechol Investigative 3870203 C6H4N2O6 200.11 C1=C(C=C(C(=C1[N+](=O)[O-])O)O)[N+](=O)[O-] EC50 = 123000 nM Poor binder T56143 Kynurenic acid receptor D0H3NS 2-oxo-2H-chromene-3-carboxylic acid Investigative 10752 C10H6O4 190.15 C1=CC=C2C(=C1)C=C(C(=O)O2)C(=O)O EC50 = 92260 nM Poor binder