TTD_Target_ID Target_Name TTD_Drug_ID Drug_Name Drug_Highest_Status Drug_PubchemID Molecular_Formula Molecular_Weight Canonical_SMILES Activity Binder_Type T14252 Gamma-aminobutyric acid transporter 4 B1GDX4 2,4-Dichloro-N-[1-[(4-iodophenyl)methyl]piperidin-4-yl]benzamide Investigative 137639241 C19H19Cl2IN2O 489.2 C1CN(CCC1NC(=O)C2=C(C=C(C=C2)Cl)Cl)CC3=CC=C(C=C3)I IC50 ~ 100000 nM Poor binder T14252 Gamma-aminobutyric acid transporter 4 B1GKJ7 1-(2-Tritylsulfanyl-ethyl)-piperidine-3-carboxylic acid Investigative 11743493 C27H29NO2S 431.6 C1CC(CN(C1)CCSC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)O IC50 = 91000 nM Poor binder T14252 Gamma-aminobutyric acid transporter 4 B2OQ0Z 2,4-Dichloro-N-[1-[(2-nitrophenyl)methyl]piperidin-4-yl]benzamide Investigative 137657292 C19H19Cl2N3O3 408.3 C1CN(CCC1NC(=O)C2=C(C=C(C=C2)Cl)Cl)CC3=CC=CC=C3[N+](=O)[O-] IC50 ~ 100000 nM Poor binder T14252 Gamma-aminobutyric acid transporter 4 B47YNW 1-{2-[(3-Fluoro-4-methoxy-phenyl)-(3-fluoro-phenyl)-phenyl-methoxy]-ethyl}-piperidine-3-carboxylic acid Investigative 9982662 C28H29F2NO4 481.5 COC1=C(C=C(C=C1)C(C2=CC=CC=C2)(C3=CC(=CC=C3)F)OCCN4CCCC(C4)C(=O)O)F IC50 = 198000 nM Poor binder T14252 Gamma-aminobutyric acid transporter 4 B5EB1C 1-{2-[(4-Methoxy-phenyl)-diphenyl-methoxy]-ethyl}-piperidine-3-carboxylic acid Investigative 10252950 C28H31NO4 445.5 COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)OCCN4CCCC(C4)C(=O)O IC50 = 178000 nM Poor binder T14252 Gamma-aminobutyric acid transporter 4 B5JF9L (1s,2s,5r)-5-Aminobicyclo[3.1.0]hexane-2-carboxylic acid Investigative 118711599 C7H11NO2 141.17 C1C[C@]2(C[C@H]2[C@H]1C(=O)O)N IC50 = 76300 nM Poor binder T14252 Gamma-aminobutyric acid transporter 4 B5JUH7 2,4-Dichloro-N-[1-(naphthalen-2-ylmethyl)piperidin-4-yl]benzamide Investigative 137638838 C23H22Cl2N2O 413.3 C1CN(CCC1NC(=O)C2=C(C=C(C=C2)Cl)Cl)CC3=CC4=CC=CC=C4C=C3 IC50 ~ 50000 nM Poor binder T14252 Gamma-aminobutyric acid transporter 4 B5VY1Q 2,4-Dichloro-N-[1-[(2-cyanophenyl)methyl]piperidin-4-yl]benzamide Investigative 137654858 C20H19Cl2N3O 388.3 C1CN(CCC1NC(=O)C2=C(C=C(C=C2)Cl)Cl)CC3=CC=CC=C3C#N IC50 ~ 50000 nM Poor binder T14252 Gamma-aminobutyric acid transporter 4 B67NTR N-(1-Benzyl-4-piperidinyl)-1,3-benzodioxole-5-carboxamide Investigative 9884272 C20H22N2O3 338.4 C1CN(CCC1NC(=O)C2=CC3=C(C=C2)OCO3)CC4=CC=CC=C4 Ki ~ 100000 nM Poor binder T14252 Gamma-aminobutyric acid transporter 4 B6XF0Q 2,4-Dichloro-N-[1-[(E)-3-phenylprop-2-enyl]piperidin-4-yl]benzamide Investigative 137638836 C21H22Cl2N2O 389.3 C1CN(CCC1NC(=O)C2=C(C=C(C=C2)Cl)Cl)C/C=C/C3=CC=CC=C3 IC50 ~ 100000 nM Poor binder T14252 Gamma-aminobutyric acid transporter 4 B7KA4R (R)-1-{2-[Tris-(4-methoxy-phenyl)-methoxy]-ethyl}-piperidine-3-carboxylic acid Investigative 6604883 C30H35NO6 505.6 COC1=CC=C(C=C1)C(C2=CC=C(C=C2)OC)(C3=CC=C(C=C3)OC)OCCN4CCC[C@H](C4)C(=O)O IC50 = 86000 nM Poor binder T14252 Gamma-aminobutyric acid transporter 4 B89XQC Methyl 4-[[4-[(2,4-dichlorobenzoyl)amino]piperidin-1-yl]methyl]benzoate Investigative 137642163 C21H22Cl2N2O3 421.3 COC(=O)C1=CC=C(C=C1)CN2CCC(CC2)NC(=O)C3=C(C=C(C=C3)Cl)Cl IC50 ~ 100000 nM Poor binder T14252 Gamma-aminobutyric acid transporter 4 BBFR86 1-{2-[Tris-(4-methoxy-phenyl)-methylsulfanyl]-ethyl}-piperidine-3-carboxylic acid Investigative 10075407 C30H35NO5S 521.7 COC1=CC=C(C=C1)C(C2=CC=C(C=C2)OC)(C3=CC=C(C=C3)OC)SCCN4CCCC(C4)C(=O)O IC50 = 142000 nM Poor binder T14252 Gamma-aminobutyric acid transporter 4 BGL58X 2,4-Dichloro-N-[1-[(4-cyanophenyl)methyl]piperidin-4-yl]benzamide Investigative 137658990 C20H19Cl2N3O 388.3 C1CN(CCC1NC(=O)C2=C(C=C(C=C2)Cl)Cl)CC3=CC=C(C=C3)C#N IC50 ~ 50000 nM Poor binder T14252 Gamma-aminobutyric acid transporter 4 BI4YL8 N-(1-Benzylpiperidin-4-yl)-2,4-dichlorobenzamide Investigative 1069892 C19H20Cl2N2O 363.3 C1CN(CCC1NC(=O)C2=C(C=C(C=C2)Cl)Cl)CC3=CC=CC=C3 Ki ~ 100000 nM Poor binder T14252 Gamma-aminobutyric acid transporter 4 BJ9W7E 1-{3-[Tris-(4-methoxy-phenyl)-methoxy]-propyl}-piperidine-3-carboxylic acid Investigative 10052359 C31H37NO6 519.6 COC1=CC=C(C=C1)C(C2=CC=C(C=C2)OC)(C3=CC=C(C=C3)OC)OCCCN4CCCC(C4)C(=O)O IC50 = 169000 nM Poor binder T14252 Gamma-aminobutyric acid transporter 4 BJHW74 2,4-Dichloro-N-(1-phenacylpiperidin-4-yl)benzamide Investigative 137638617 C20H20Cl2N2O2 391.3 C1CN(CCC1NC(=O)C2=C(C=C(C=C2)Cl)Cl)CC(=O)C3=CC=CC=C3 IC50 ~ 100000 nM Poor binder T14252 Gamma-aminobutyric acid transporter 4 BLOW98 (R,E)-1-(4-(2-Fluorophenyl)-4-o-tolylbut-3-enyl)piperidine-3-carboxylic acid Investigative 50941729 C23H26FNO2 367.5 CC1=CC=CC=C1/C(=C\\CCN2CCC[C@H](C2)C(=O)O)/C3=CC=CC=C3F IC50 ~ 100000 nM Poor binder T14252 Gamma-aminobutyric acid transporter 4 BO0UY4 1-[2-[9-(4-Methoxyphenyl)fluoren-9-yl]oxyethyl]piperidine-3-carboxylic Acid Investigative 10072112 C28H29NO4 443.5 COC1=CC=C(C=C1)C2(C3=CC=CC=C3C4=CC=CC=C42)OCCN5CCCC(C5)C(=O)O IC50 = 142000 nM Poor binder T14252 Gamma-aminobutyric acid transporter 4 BPA2B9 2,4-Dichloro-N-[1-(quinolin-2-ylmethyl)piperidin-4-yl]benzamide Investigative 137659917 C22H21Cl2N3O 414.3 C1CN(CCC1NC(=O)C2=C(C=C(C=C2)Cl)Cl)CC3=NC4=CC=CC=C4C=C3 IC50 ~ 50000 nM Poor binder T14252 Gamma-aminobutyric acid transporter 4 BXG3Y0 2,4-Dichloro-N-[1-[(4-nitrophenyl)methyl]piperidin-4-yl]benzamide Investigative 137638595 C19H19Cl2N3O3 408.3 C1CN(CCC1NC(=O)C2=C(C=C(C=C2)Cl)Cl)CC3=CC=C(C=C3)[N+](=O)[O-] IC50 ~ 100000 nM Poor binder T14252 Gamma-aminobutyric acid transporter 4 D0D2EF (R)-nipecotic acid Investigative 1796510 C6H11NO2 129.16 C1C[C@H](CNC1)C(=O)O IC50 = 51000 nM Poor binder T14252 Gamma-aminobutyric acid transporter 4 D0V5OY N-(1-benzylpiperidine-4-yl)-2-naphthamide Investigative 16725912 C23H24N2O 344.4 C1CN(CCC1NC(=O)C2=CC3=CC=CC=C3C=C2)CC4=CC=CC=C4 Ki ~ 100000 nM Poor binder T14252 Gamma-aminobutyric acid transporter 4 D0V7RG 4-substituted 2,4-dioxobutanoic acids Investigative 3532 C6H9NO2 127.14 C1CNCC(=C1)C(=O)O IC50 = 110000 nM Poor binder