TTD_Target_ID Target_Name TTD_Drug_ID Drug_Name Drug_Highest_Status Drug_PubchemID Molecular_Formula Molecular_Weight Canonical_SMILES Activity Binder_Type T69494 N-methyl-D-aspartate receptor D02VKC NBQX Phase 1 3272524 C12H8N4O6S 336.28 C1=CC2=C3C(=CC(=C2C(=C1)S(=O)(=O)N)[N+](=O)[O-])NC(=O)C(=O)N3 IC50 ~ 100000 nM Poor binder T69494 N-methyl-D-aspartate receptor B0GNJ3 Amino(2-(3-Nitrobenzylidene)Hydrazinyl)Methaniminium Chloride Investigative 44118332 C8H10ClN5O2 243.65 C1=CC(=CC(=C1)[N+](=O)[O-])/C=N/N=C(N)N.Cl IC50 = 154881.66 nM Poor binder T69494 N-methyl-D-aspartate receptor B1A2BW Amino(2-(4-Methylbenzylidene)Hydrazinyl)Methaniminium Chloride Investigative 49796489 C9H13ClN4 212.68 CC1=CC=C(C=C1)/C=N/N=C(N)N.Cl IC50 = 81283.05 nM Poor binder T69494 N-methyl-D-aspartate receptor B1TAS7 Amino(2-Benzylidenehydrazinyl)Methaniminium Chloride Investigative 49796212 C8H11ClN4 198.65 C1=CC=C(C=C1)/C=N/N=C(N)N.Cl IC50 = 72443.6 nM Poor binder T69494 N-methyl-D-aspartate receptor B2TG6D Amino(2-(3-Phenylallylidene)Hydrazinyl)Methaniminium Chloride Investigative 71717118 C10H13ClN4 224.69 C1=CC=C(C=C1)/C=C/C=N/N=C(N)N.Cl IC50 = 58884.37 nM Poor binder T69494 N-methyl-D-aspartate receptor B2WX8V 1-[[3-[[Carbamimidoyl(2-methylpropyl)amino]methyl]phenyl]methyl]-1-(2-methylpropyl)guanidine;dihydrochloride Investigative 49796559 C18H34Cl2N6 405.4 CC(C)CN(CC1=CC(=CC=C1)CN(CC(C)C)C(=N)N)C(=N)N.Cl.Cl IC50 = 112030 nM Poor binder T69494 N-methyl-D-aspartate receptor B3T4OA 2-Amino-3-[3-hydroxy-5-(1-methyl-1H-tetrazol-5-yl)-isoxazol-4-yl]-propionic acid Investigative 10658567 C8H10N6O4 254.2 CN1C(=NN=N1)C2=C(C(=O)NO2)CC(C(=O)O)N IC50 ~ 100000 nM Poor binder T69494 N-methyl-D-aspartate receptor B47EFT 1,3-Bis(4-amino-2-methylphenyl)guanidine Investigative 14771731 C15H19N5 269.34 CC1=C(C=CC(=C1)N)NC(=NC2=C(C=C(C=C2)N)C)N IC50 ~ 100000 nM Poor binder T69494 N-methyl-D-aspartate receptor B4ET2B 2-[(E)-1H-Pyrrol-2-ylmethylideneamino]guanidine;hydrochloride Investigative 135422276 C6H10ClN5 187.63 C1=CNC(=C1)/C=N/N=C(N)N.Cl IC50 = 95499.26 nM Poor binder T69494 N-methyl-D-aspartate receptor B4H7ER 6-Chloro-4-hydroxy-3-phenyl-1H-1,8-naphthyridin-2-one Investigative 54730148 C14H9ClN2O2 272.68 C1=CC=C(C=C1)C2=C(C3=C(NC2=O)N=CC(=C3)Cl)O IC50 ~ 100000 nM Poor binder T69494 N-methyl-D-aspartate receptor B4U0WM (2R)-2-Amino-3-(2H-tetrazol-5-yl)propanoic acid Investigative 44362600 C4H7N5O2 157.13 C(C1=NNN=N1)[C@H](C(=O)O)N IC50 ~ 100000 nM Poor binder T69494 N-methyl-D-aspartate receptor B5NY2R (2S)-2-Amino-3-(2H-tetrazol-5-yl)propanoic acid Investigative 3246533 C4H7N5O2 157.13 C(C1=NNN=N1)[C@@H](C(=O)O)N IC50 ~ 100000 nM Poor binder T69494 N-methyl-D-aspartate receptor B6L0HM Amino(2-(3-(Methoxycarbonyl)Benzylidene)Hydrazinyl)Methaniminium Chloride Investigative 71584184 C10H13ClN4O2 256.69 COC(=O)C1=CC=CC(=C1)/C=N/N=C(N)N.Cl IC50 = 72443.6 nM Poor binder T69494 N-methyl-D-aspartate receptor B6SBC2 Amino(2-(4-(Methoxycarbonyl)Benzylidene)Hydrazinyl)Methaniminium Chloride Investigative 71719560 C10H13ClN4O2 256.69 COC(=O)C1=CC=C(C=C1)/C=N/N=C(N)N.Cl IC50 = 70794.58 nM Poor binder T69494 N-methyl-D-aspartate receptor B6UV1Q 2-Amino-3-[5-(2-methyl-1,2,4-triazol-3-yl)-3-oxo-1,2-oxazol-4-yl]propanoic acid Investigative 10729534 C9H11N5O4 253.22 CN1C(=NC=N1)C2=C(C(=O)NO2)CC(C(=O)O)N IC50 ~ 100000 nM Poor binder T69494 N-methyl-D-aspartate receptor B78WRA (1R,Alphar)-1,2,3,4-Tetrahydro-2-methyl-6,7-dimethoxy-alpha-(4-chlorophenyl)-1-isoquinolineethanol Investigative 9998705 C20H24ClNO3 361.9 CN1CCC2=CC(=C(C=C2[C@H]1C[C@H](C3=CC=C(C=C3)Cl)O)OC)OC IC50 = 56000 nM Poor binder T69494 N-methyl-D-aspartate receptor B7C4DT 5-Acetoxy-1,4-dihydro-6,7-dimethoxyquinoxaline-2,3-dione Investigative 11747939 C12H12N2O6 280.23 CC(=O)OC1=C2C(=CC(=C1OC)OC)NC(=O)C(=O)N2 IC50 = 53000 nM Poor binder T69494 N-methyl-D-aspartate receptor B7FI1S n,n-Diphenylguanidine Investigative 14657 C13H13N3 211.26 C1=CC=C(C=C1)N(C2=CC=CC=C2)C(=N)N IC50 ~ 100000 nM Poor binder T69494 N-methyl-D-aspartate receptor B7X5YI 2-Amino-8-(2H-tetrazol-5-yl)octanoic acid;hydrochloride Investigative 45262360 C9H18ClN5O2 263.72 C(CCCC(C(=O)O)N)CCC1=NNN=N1.Cl IC50 ~ 100000 nM Poor binder T69494 N-methyl-D-aspartate receptor B80DEG (1S,Alphar)-1,2,3,4-Tetrahydro-6,7-dimethoxy-alpha-(4-methoxyphenyl)-1-isoquinolineethanol Investigative 10783594 C20H25NO4 343.4 COC1=CC=C(C=C1)[C@@H](C[C@H]2C3=CC(=C(C=C3CCN2)OC)OC)O IC50 = 110000 nM Poor binder T69494 N-methyl-D-aspartate receptor B8ERL6 2-[(E)-[5-(4-Nitrophenyl)furan-2-yl]methylideneamino]guanidine;hydrochloride Investigative 71584311 C12H12ClN5O3 309.71 C1=CC(=CC=C1C2=CC=C(O2)/C=N/N=C(N)N)[N+](=O)[O-].Cl IC50 = 109647.82 nM Poor binder T69494 N-methyl-D-aspartate receptor B8HJ1A 5,8-Dihydro-[1,3]dioxolo[4,5-g]quinoxaline-6,7-dione Investigative 10845927 C9H6N2O4 206.15 C1OC2=C(O1)C=C3C(=C2)NC(=O)C(=O)N3 IC50 ~ 100000 nM Poor binder T69494 N-methyl-D-aspartate receptor B9AB0O Amino(2-(4-Nitrobenzylidene)Hydrazinyl)Methaniminium Chloride Investigative 44118333 C8H10ClN5O2 243.65 C1=CC(=CC=C1/C=N/N=C(N)N)[N+](=O)[O-].Cl IC50 = 77624.71 nM Poor binder T69494 N-methyl-D-aspartate receptor B9L7NR 1-[[3-[[Carbamimidoyl(propyl)amino]methyl]-5-hydroxyphenyl]methyl]-1-propylguanidine;dihydrochloride Investigative 49796550 C16H30Cl2N6O 393.4 CCCN(CC1=CC(=CC(=C1)O)CN(CCC)C(=N)N)C(=N)N.Cl.Cl IC50 = 110500 nM Poor binder T69494 N-methyl-D-aspartate receptor B9OP3N (2R)-2-(2-Aminoethylamino)propanoic acid Investigative 13477634 C5H12N2O2 132.16 C[C@H](C(=O)O)NCCN IC50 = 112000 nM Poor binder T69494 N-methyl-D-aspartate receptor BB2W3Z 4-Hydroxy-3-phenyl-1,5-naphthyridin-2(1H)-one Investigative 54730140 C14H10N2O2 238.24 C1=CC=C(C=C1)C2=C(C3=C(C=CC=N3)NC2=O)O IC50 ~ 100000 nM Poor binder T69494 N-methyl-D-aspartate receptor BB38MN (1R,Alphar)-1,2,3,4-Tetrahydro-6,7-dimethoxy-alpha-(4-methoxyphenyl)-1-isoquinolineethanol Investigative 10617348 C20H25NO4 343.4 COC1=CC=C(C=C1)[C@@H](C[C@@H]2C3=CC(=C(C=C3CCN2)OC)OC)O IC50 = 120000 nM Poor binder T69494 N-methyl-D-aspartate receptor BDIS47 (1R,Alphas)-1,2,3,4-Tetrahydro-2-methyl-6,7-dimethoxy-alpha-(4-methoxyphenyl)-1-isoquinolineethanol Investigative 10666040 C21H27NO4 357.4 CN1CCC2=CC(=C(C=C2[C@H]1C[C@@H](C3=CC=C(C=C3)OC)O)OC)OC IC50 = 120000 nM Poor binder T69494 N-methyl-D-aspartate receptor BDSQ52 3-Nitro-4-hydroxy-5,6,7,8-tetrafluoroquinolin-2(1H)-one Investigative 54713079 C9H2F4N2O4 278.12 C12=C(C(=C(C(=C1F)F)F)F)NC(=O)C(=C2O)[N+](=O)[O-] IC50 ~ 100000 nM Poor binder T69494 N-methyl-D-aspartate receptor BF8A0Y 2-[(E)-(3-Hydroxy-4-methoxyphenyl)methylideneamino]guanidine;hydrochloride Investigative 71717743 C9H13ClN4O2 244.68 COC1=C(C=C(C=C1)/C=N/N=C(N)N)O.Cl IC50 = 63095.73 nM Poor binder T69494 N-methyl-D-aspartate receptor BFG86N 2-[(E)-Thiophen-3-ylmethylideneamino]guanidine;hydrochloride Investigative 71584446 C6H9ClN4S 204.68 C1=CSC=C1/C=N/N=C(N)N.Cl IC50 = 181970.09 nM Poor binder T69494 N-methyl-D-aspartate receptor BFWG19 4-Hydroxy-3-phenyl-1,8-naphthyridin-2(1H)-one Investigative 54697760 C14H10N2O2 238.24 C1=CC=C(C=C1)C2=C(C3=C(NC2=O)N=CC=C3)O IC50 ~ 100000 nM Poor binder T69494 N-methyl-D-aspartate receptor BH2PG8 Amino(2-(2,4-Difluorobenzylidene)Hydrazinyl)Methaniminium Chloride Investigative 71584304 C8H9ClF2N4 234.63 C1=CC(=C(C=C1F)F)/C=N/N=C(N)N.Cl IC50 = 54954.09 nM Poor binder T69494 N-methyl-D-aspartate receptor BI5J2V 2-[3-(Diethylamino)propyl]-2-methyl-4-phenylfuran-3-one;hydrochloride Investigative 45260674 C18H26ClNO2 323.9 CCN(CC)CCCC1(C(=O)C(=CO1)C2=CC=CC=C2)C.Cl Ki = 100000 nM Poor binder T69494 N-methyl-D-aspartate receptor BIWK86 2-Amino-7-(2H-tetrazol-5-yl)heptanoic acid Investigative 44362880 C8H15N5O2 213.24 C(CCC1=NNN=N1)CCC(C(=O)O)N IC50 ~ 100000 nM Poor binder T69494 N-methyl-D-aspartate receptor BJ5BK1 (1S,Alphar)-1,2,3,4-Tetrahydro-6,7-dimethoxy-alpha-(4-chlorophenyl)-1-isoquinolineethanol Investigative 10497883 C19H22ClNO3 347.8 COC1=C(C=C2[C@@H](NCCC2=C1)C[C@H](C3=CC=C(C=C3)Cl)O)OC IC50 = 95000 nM Poor binder T69494 N-methyl-D-aspartate receptor BK2VX9 (1R,Alphas)-1,2,3,4-Tetrahydro-6,7-dimethoxy-alpha-(4-methoxyphenyl)-1-isoquinolineethanol Investigative 10783593 C20H25NO4 343.4 COC1=CC=C(C=C1)[C@H](C[C@@H]2C3=CC(=C(C=C3CCN2)OC)OC)O IC50 = 140000 nM Poor binder T69494 N-methyl-D-aspartate receptor BKOH49 1-[[3-[[Carbamimidoyl(propyl)amino]methyl]-5-methoxyphenyl]methyl]-1-propylguanidine;dihydrochloride Investigative 49796552 C17H32Cl2N6O 407.4 CCCN(CC1=CC(=CC(=C1)OC)CN(CCC)C(=N)N)C(=N)N.Cl.Cl IC50 = 55260 nM Poor binder T69494 N-methyl-D-aspartate receptor BM65ZG 2-Amino-3-[3-hydroxy-5-(2-methyl-2H-tetrazol-5-yl)-isoxazol-4-yl]-propionic acid Investigative 3481675 C8H10N6O4 254.2 CN1N=C(N=N1)C2=C(C(=O)NO2)CC(C(=O)O)N IC50 ~ 100000 nM Poor binder T69494 N-methyl-D-aspartate receptor BMH0S9 2-Amino-3-[3-oxo-5-(2H-tetrazol-5-yl)-1,2-oxazol-4-yl]propanoic Acid Investigative 10800053 C7H8N6O4 240.18 C(C1=C(ONC1=O)C2=NNN=N2)C(C(=O)O)N IC50 ~ 100000 nM Poor binder T69494 N-methyl-D-aspartate receptor BMI8G9 2-Amino-3-[3-oxo-5-(1H-1,2,4-triazol-5-yl)-1,2-oxazol-4-yl]propanoic acid Investigative 10752476 C8H9N5O4 239.19 C1=NNC(=N1)C2=C(C(=O)NO2)CC(C(=O)O)N IC50 ~ 100000 nM Poor binder T69494 N-methyl-D-aspartate receptor BO32KM Amino(2-(2-Fluorobenzylidene)Hydrazinyl)Methaniminium Chloride Investigative 71716508 C8H10ClFN4 216.64 C1=CC=C(C(=C1)/C=N/N=C(N)N)F.Cl IC50 = 74131.02 nM Poor binder T69494 N-methyl-D-aspartate receptor BORD40 2-Amino-3-[5-(1-methyl-1,2,4-triazol-3-yl)-3-oxo-1,2-oxazol-4-yl]propanoic acid Investigative 10824747 C9H11N5O4 253.22 CN1C=NC(=N1)C2=C(C(=O)NO2)CC(C(=O)O)N IC50 ~ 100000 nM Poor binder T69494 N-methyl-D-aspartate receptor BP58CG 2-Amino-3-[5-(1H-imidazol-2-yl)-3-oxo-1,2-oxazol-4-yl]propanoic acid Investigative 10823814 C9H10N4O4 238.2 C1=CN=C(N1)C2=C(C(=O)NO2)CC(C(=O)O)N IC50 ~ 100000 nM Poor binder T69494 N-methyl-D-aspartate receptor BP98VD 3-[3-(Ethylamino)propanoylamino]propanoic acid Investigative 25211257 C8H16N2O3 188.22 CCNCCC(=O)NCCC(=O)O IC50 = 60000 nM Poor binder T69494 N-methyl-D-aspartate receptor BPN3O1 2-Amino-3-[3-oxo-5-(1,3-thiazol-2-yl)-1,2-oxazol-4-yl]propanoic Acid Investigative 10562939 C9H9N3O4S 255.25 C1=CSC(=N1)C2=C(C(=O)NO2)CC(C(=O)O)N IC50 ~ 100000 nM Poor binder T69494 N-methyl-D-aspartate receptor BQ4RN0 3-Nitro-4-hydroxy-6,7,8-trichloroquinolin-2(1H)-one Investigative 54704589 C9H3Cl3N2O4 309.5 C1=C2C(=C(C(=C1Cl)Cl)Cl)NC(=O)C(=C2O)[N+](=O)[O-] IC50 ~ 100000 nM Poor binder T69494 N-methyl-D-aspartate receptor BQA7D5 Amino(2-(4-Fluorobenzylidene)Hydrazinyl)Methaniminium Chloride Investigative 71720158 C8H10ClFN4 216.64 C1=CC(=CC=C1/C=N/N=C(N)N)F.Cl IC50 = 91201.08 nM Poor binder T69494 N-methyl-D-aspartate receptor BS26GV 2-[(E)-1H-Indol-2-ylmethylideneamino]guanidine;hydrochloride Investigative 136250345 C10H12ClN5 237.69 C1=CC=C2C(=C1)C=C(N2)/C=N/N=C(N)N.Cl IC50 = 57543.99 nM Poor binder T69494 N-methyl-D-aspartate receptor BSJ9M0 2-[(E)-1H-Indol-5-ylmethylideneamino]guanidine;hydrochloride Investigative 71584314 C10H12ClN5 237.69 C1=CC2=C(C=CN2)C=C1/C=N/N=C(N)N.Cl IC50 = 50118.72 nM Poor binder T69494 N-methyl-D-aspartate receptor BU08IJ Amino(2-(4-Aminobenzylidene)Hydrazinyl)Methaniminium Chloride Investigative 71720799 C8H12ClN5 213.67 C1=CC(=CC=C1/C=N/N=C(N)N)N.Cl IC50 = 109647.82 nM Poor binder T69494 N-methyl-D-aspartate receptor BU27PT 2-Amino-3-[5-(1-methylimidazol-2-yl)-3-oxo-1,2-oxazol-4-yl]propanoic acid Investigative 10610792 C10H12N4O4 252.23 CN1C=CN=C1C2=C(C(=O)NO2)CC(C(=O)O)N IC50 ~ 100000 nM Poor binder T69494 N-methyl-D-aspartate receptor BU4A6G 2-(4-Aminobutanamido)acetic acid Investigative 12150769 C6H12N2O3 160.17 C(CC(=O)NCC(=O)O)CN IC50 = 61000 nM Poor binder T69494 N-methyl-D-aspartate receptor BUL8Y4 1-[[3-[[Carbamimidoyl(ethyl)amino]methyl]phenyl]methyl]-1-ethylguanidine;dihydrochloride Investigative 49796532 C14H26Cl2N6 349.3 CCN(CC1=CC(=CC=C1)CN(CC)C(=N)N)C(=N)N.Cl.Cl IC50 = 75800 nM Poor binder T69494 N-methyl-D-aspartate receptor BUP3Q8 3-Nitro-4-hydroxy-5-chloroquinolin-2(1H)-one Investigative 54708009 C9H5ClN2O4 240.6 C1=CC2=C(C(=C1)Cl)C(=C(C(=O)N2)[N+](=O)[O-])O IC50 = 61000 nM Poor binder T69494 N-methyl-D-aspartate receptor BWE27G 2(1H)-Quinolinone, 6-chloro-4-hydroxy-3-nitro- Investigative 54705784 C9H5ClN2O4 240.6 C1=CC2=C(C=C1Cl)C(=C(C(=O)N2)[N+](=O)[O-])O IC50 ~ 100000 nM Poor binder T69494 N-methyl-D-aspartate receptor BWG6E3 1-[[6-[[Carbamimidoyl(propyl)amino]methyl]pyridin-2-yl]methyl]-1-propylguanidine;dihydrochloride Investigative 49796535 C15H29Cl2N7 378.3 CCCN(CC1=NC(=CC=C1)CN(CCC)C(=N)N)C(=N)N.Cl.Cl IC50 = 95210 nM Poor binder T69494 N-methyl-D-aspartate receptor BY27DB 8-Chloroquinoline-2,3,4(1H)-trione 3-oxime Investigative 135522010 C9H5ClN2O3 224.6 C1=CC2=C(C(=C1)Cl)NC(=O)C(=C2O)N=O IC50 ~ 100000 nM Poor binder T69494 N-methyl-D-aspartate receptor BY36CF (1S,Alphar)-1,2,3,4-Tetrahydro-2-methyl-6,7-dimethoxy-alpha-(4-chlorophenyl)-1-isoquinolineethanol Investigative 10546555 C20H24ClNO3 361.9 CN1CCC2=CC(=C(C=C2[C@@H]1C[C@H](C3=CC=C(C=C3)Cl)O)OC)OC IC50 = 52000 nM Poor binder T69494 N-methyl-D-aspartate receptor BYO8S0 8-Chloro-4-hydroxy-3-nitroquinolin-2(1H)-one Investigative 54696453 C9H5ClN2O4 240.6 C1=CC2=C(C(=C1)Cl)NC(=O)C(=C2O)[N+](=O)[O-] IC50 ~ 100000 nM Poor binder T69494 N-methyl-D-aspartate receptor BZDK59 2,3-Quinoxalinedione, 1,4-dihydro-6,7-dihydroxy- Investigative 10774166 C8H6N2O4 194.14 C1=C2C(=CC(=C1O)O)NC(=O)C(=O)N2 IC50 ~ 100000 nM Poor binder T69494 N-methyl-D-aspartate receptor D03RGP (R,S)-AMPA Investigative 1221 C7H10N2O4 186.17 CC1=C(C(=O)NO1)CC(C(=O)O)N IC50 ~ 100000 nM Poor binder T69494 N-methyl-D-aspartate receptor D0S6HI arcaine Investigative 2227 C6H16N6 172.23 C(CCN=C(N)N)CN=C(N)N IC50 = 79980 nM Poor binder