TTD_Target_ID Target_Name TTD_Drug_ID Drug_Name Drug_Highest_Status Drug_PubchemID Molecular_Formula Molecular_Weight Canonical_SMILES Activity Binder_Type T55959 Dopamine transporter D01AXB Duloxetine Approved 60835 C18H19NOS 297.4 CNCC[C@@H](C1=CC=CS1)OC2=CC=CC3=CC=CC=C32 Ki = 240000 nM Non binder T55959 Dopamine transporter D0R6LF Citalopram derivative 1 Patented 2771 C20H21FN2O 324.4 CN(C)CCCC1(C2=C(CO1)C=C(C=C2)C#N)C3=CC=C(C=C3)F Ki > 1000000 nM Non binder T55959 Dopamine transporter B09TKB Methyl 2-(4-tert-butylphenyl)cyclohex-1-enecarboxylate Investigative 44429205 C18H24O2 272.4 CC(C)(C)C1=CC=C(C=C1)C2=C(CCCC2)C(=O)OC Ki = 605000 nM Non binder T55959 Dopamine transporter B0L1TW Methyl 2-(3-chlorophenyl)cyclohex-1-enecarboxylate Investigative 44429202 C14H15ClO2 250.72 COC(=O)C1=C(CCCC1)C2=CC(=CC=C2)Cl Ki = 8510000000000 nM Non binder T55959 Dopamine transporter B19SPY Methyl 3-(3,4-dichlorophenyl)bicyclo[2.2.1]hept-2-ene-2-carboxylate Investigative 44434532 C15H14Cl2O2 297.2 COC(=O)C1=C(C2CCC1C2)C3=CC(=C(C=C3)Cl)Cl Ki = 148000000000000 nM Non binder T55959 Dopamine transporter B1VG9T (2S,3S,4S,5R,6S)-6-[1-[(2S,3R,4S,5S,6S)-6-Carboxy-3,4,5-trihydroxyoxan-2-yl]oxy-5-[(1S)-3-(methylamino)-1-thiophen-2-ylpropoxy]naphthalen-2-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid Investigative 70681491 C30H35NO15S 681.7 CNCC[C@@H](C1=CC=CS1)OC2=CC=CC3=C2C=CC(=C3O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)O)O)O)O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)C(=O)O)O)O)O Ki > 10000000 nM Non binder T55959 Dopamine transporter B2A0WO Methyl 3-(4-chlorophenyl)-7-oxabicyclo[2.2.1]hept-2-ene-2-carboxylate Investigative 44434540 C14H13ClO3 264.7 COC(=O)C1=C(C2CCC1O2)C3=CC=C(C=C3)Cl Ki = 55000000000000 nM Non binder T55959 Dopamine transporter B2L4GB (2S,3S,4S,5R,6S)-3,4,5-Trihydroxy-6-[2-methoxy-5-[(1S)-3-(methylamino)-1-thiophen-2-ylpropoxy]naphthalen-1-yl]oxyoxane-2-carboxylic acid Investigative 70683608 C25H29NO9S 519.6 CNCC[C@@H](C1=CC=CS1)OC2=CC=CC3=C2C=CC(=C3O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)O)O)O)O)OC Ki > 10000000 nM Non binder T55959 Dopamine transporter B2LW5E Methyl 3-(3-chlorophenyl)bicyclo[2.2.1]hept-2-ene-2-carboxylate Investigative 44434543 C15H15ClO2 262.73 COC(=O)C1=C(C2CCC1C2)C3=CC(=CC=C3)Cl Ki = 9550000000000 nM Non binder T55959 Dopamine transporter B2MFZ7 Methyl 2-(4-(trifluoromethoxy)phenyl)cyclohexanecarboxylate Investigative 44429395 C15H17F3O3 302.29 COC(=O)[C@@H]1CCCC[C@@H]1C2=CC=C(C=C2)OC(F)(F)F Ki = 1180000 nM Non binder T55959 Dopamine transporter B3F2UW Methyl 3-(4-phenylphenyl)-7-azabicyclo[2.2.1]hept-2-ene-2-carboxylate Investigative 44434537 C20H19NO2 305.4 COC(=O)C1=C(C2CCC1N2)C3=CC=C(C=C3)C4=CC=CC=C4 Ki = 40700000000000 nM Non binder T55959 Dopamine transporter B3NIT7 Methyl 2-(4-hydroxyphenyl)cyclohex-1-enecarboxylate Investigative 44429212 C14H16O3 232.27 COC(=O)C1=C(CCCC1)C2=CC=C(C=C2)O Ki = 231000 nM Non binder T55959 Dopamine transporter B4QM5H Methyl 2-(3-(trifluoromethyl)phenyl)cyclohex-1-enecarboxylate Investigative 44429209 C15H15F3O2 284.27 COC(=O)C1=C(CCCC1)C2=CC(=CC=C2)C(F)(F)F Ki = 1050000 nM Non binder T55959 Dopamine transporter B5D2PQ O-Methylcorypalline Investigative 27694 C12H17NO2 207.27 CN1CCC2=CC(=C(C=C2C1)OC)OC Ki > 10000000 nM Non binder T55959 Dopamine transporter B6TN1J Methyl 3-(3,4-dichlorophenyl)-7-azabicyclo[2.2.1]hept-2-ene-2-carboxylate Investigative 44434539 C14H13Cl2NO2 298.2 COC(=O)C1=C(C2CCC1N2)C3=CC(=C(C=C3)Cl)Cl Ki = 912000000000000 nM Non binder T55959 Dopamine transporter B6X2ZM 5-Hydroxyduloxetine Investigative 44344235 C18H19NO2S 313.4 CNCC[C@@H](C1=CC=CS1)OC2=CC=CC3=C2C=CC=C3O Ki = 240500 nM Non binder T55959 Dopamine transporter B7RFB6 4-Hydroxy Duloxetine b-D-Glucuronide Investigative 29981513 C24H27NO8S 489.5 CNCC[C@@H](C1=CC=CS1)OC2=CC=C(C3=CC=CC=C32)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)O)O)O)O Ki = 3509000 nM Non binder T55959 Dopamine transporter B87XMC Methyl 2-(biphenyl-4-yl)cyclohex-1-enecarboxylate Investigative 44429204 C20H20O2 292.4 COC(=O)C1=C(CCCC1)C2=CC=C(C=C2)C3=CC=CC=C3 Ki = 264000 nM Non binder T55959 Dopamine transporter B9EL3Z Methyl 3-(4-chlorophenyl)-7-azabicyclo[2.2.1]hept-2-ene-2-carboxylate Investigative 44434538 C14H14ClNO2 263.72 COC(=O)C1=C(C2CCC1N2)C3=CC=C(C=C3)Cl Ki = 37200000000000 nM Non binder T55959 Dopamine transporter B9RYC1 Methyl 2-(4-acetylphenyl)cyclopent-1-enecarboxylate Investigative 44429197 C15H16O3 244.28 CC(=O)C1=CC=C(C=C1)C2=C(CCC2)C(=O)OC Ki = 335000 nM Non binder T55959 Dopamine transporter BA7Q1C Methyl 2-(naphthalen-2-yl)cyclopent-1-enecarboxylate Investigative 44429192 C17H16O2 252.31 COC(=O)C1=C(CCC1)C2=CC3=CC=CC=C3C=C2 Ki = 240000000000000 nM Non binder T55959 Dopamine transporter BAK83J Methyl 3-(4-phenylphenyl)bicyclo[2.2.1]hept-2-ene-2-carboxylate Investigative 44434530 C21H20O2 304.4 COC(=O)C1=C(C2CCC1C2)C3=CC=C(C=C3)C4=CC=CC=C4 Ki = 1660000000000 nM Non binder T55959 Dopamine transporter BB6E4L Methyl 2-(3-(trifluoromethyl)phenyl)cyclohexanecarboxylate Investigative 44429397 C15H17F3O2 286.29 COC(=O)[C@@H]1CCCC[C@@H]1C2=CC(=CC=C2)C(F)(F)F Ki = 569000 nM Non binder T55959 Dopamine transporter BC36LD Methyl 2-(4-(trifluoromethoxy)phenyl)cyclohex-1-enecarboxylate Investigative 44429206 C15H15F3O3 300.27 COC(=O)C1=C(CCCC1)C2=CC=C(C=C2)OC(F)(F)F Ki = 1660000 nM Non binder T55959 Dopamine transporter BD0OG2 Methyl 2-phenylcyclohexene-1-carboxylate Investigative 44429207 C14H16O2 216.27 COC(=O)C1=C(CCCC1)C2=CC=CC=C2 Ki = 630000 nM Non binder T55959 Dopamine transporter BD6BA1 4-(Benzhydrylsulfinylmethyl)-2,3-dimethylthiophene Investigative 137655750 C20H20OS2 340.5 CC1=C(SC=C1CS(=O)C(C2=CC=CC=C2)C3=CC=CC=C3)C IC50 = 283600 nM Non binder T55959 Dopamine transporter BDWB03 Methyl 3-(2-chlorophenyl)bicyclo[2.2.1]hept-2-ene-2-carboxylate Investigative 44434533 C15H15ClO2 262.73 COC(=O)C1=C(C2CCC1C2)C3=CC=CC=C3Cl Ki = 2690000000000 nM Non binder T55959 Dopamine transporter BE04LO Methyl 2-(4-tert-butylphenyl)cyclopent-1-enecarboxylate Investigative 44429194 C17H22O2 258.35 CC(C)(C)C1=CC=C(C=C1)C2=C(CCC2)C(=O)OC Ki = 302000 nM Non binder T55959 Dopamine transporter BFZ45K Sodium 2-methoxy-5-[(1S)-3-(methylamino)-1-(thiophen-2-yl)propoxy]naphthalen-1-yl sulfate Investigative 44344091 C19H20NNaO6S2 445.5 CNCC[C@@H](C1=CC=CS1)OC2=CC=CC3=C2C=CC(=C3OS(=O)(=O)[O-])OC.[Na+] Ki > 10000000 nM Non binder T55959 Dopamine transporter BG6W3D Methyl 3-naphthalen-2-ylbicyclo[2.2.1]hept-2-ene-2-carboxylate Investigative 44434541 C19H18O2 278.3 COC(=O)C1=C(C2CCC1C2)C3=CC4=CC=CC=C4C=C3 Ki = 234000000000000 nM Non binder T55959 Dopamine transporter BG9NS6 Methyl 3-(3-chlorophenyl)-7-azabicyclo[2.2.1]hept-2-ene-2-carboxylate Investigative 44434544 C14H14ClNO2 263.72 COC(=O)C1=C(C2CCC1N2)C3=CC(=CC=C3)Cl Ki = 29500000000000 nM Non binder T55959 Dopamine transporter BGI86B Methyl 2-(4-(trifluoromethoxy)phenyl)cyclopent-1-enecarboxylate Investigative 44429195 C14H13F3O3 286.25 COC(=O)C1=C(CCC1)C2=CC=C(C=C2)OC(F)(F)F Ki = 2649000 nM Non binder T55959 Dopamine transporter BHEM18 Methyl 2-(biphenyl-4-yl)cycloheptanecarboxylate Investigative 44429400 C21H24O2 308.4 COC(=O)[C@@H]1CCCCC[C@@H]1C2=CC=C(C=C2)C3=CC=CC=C3 Ki = 313000 nM Non binder T55959 Dopamine transporter BKY43I 5-Hydroxy-6-methoxy Duloxetine Investigative 29981679 C19H21NO3S 343.4 CNCC[C@@H](C1=CC=CS1)OC2=CC=CC3=C2C=CC(=C3O)OC Ki = 2814000 nM Non binder T55959 Dopamine transporter BL6A8G Methyl 2-(4-tert-butylphenyl)cyclohept-1-enecarboxylate Investigative 44429402 C19H26O2 286.4 CC(C)(C)C1=CC=C(C=C1)C2=C(CCCCC2)C(=O)OC Ki = 884000 nM Non binder T55959 Dopamine transporter BL7JV0 Methyl 2-phenylcyclohexanecarboxylate Investigative 44429396 C14H18O2 218.29 COC(=O)[C@@H]1CCCC[C@@H]1C2=CC=CC=C2 Ki = 975000 nM Non binder T55959 Dopamine transporter BLYC86 Methyl 2-(3-chlorophenyl)cyclopent-1-enecarboxylate Investigative 44429191 C13H13ClO2 236.69 COC(=O)C1=C(CCC1)C2=CC(=CC=C2)Cl Ki = 28800000000000 nM Non binder T55959 Dopamine transporter BOY34A Methyl 3-(2,4-dichlorophenyl)bicyclo[2.2.1]hept-2-ene-2-carboxylate Investigative 44434535 C15H14Cl2O2 297.2 COC(=O)C1=C(C2CCC1C2)C3=C(C=C(C=C3)Cl)Cl Ki = 43700000000000 nM Non binder T55959 Dopamine transporter BP0RB5 1-Methoxy-5-((S)-3-methylamino-1-thiophen-2-yl-propoxy)-naphthalen-2-ol Investigative 44344218 C19H21NO3S 343.4 CNCC[C@@H](C1=CC=CS1)OC2=CC=CC3=C2C=CC(=C3OC)O Ki = 353000 nM Non binder T55959 Dopamine transporter BPNJ26 Methyl 2-(4-tert-butylphenyl)cycloheptanecarboxylate Investigative 44429401 C19H28O2 288.4 CC(C)(C)C1=CC=C(C=C1)[C@H]2CCCCC[C@H]2C(=O)OC Ki = 1140000 nM Non binder T55959 Dopamine transporter BQ9N7C Methyl 3-phenyl-7-azabicyclo[2.2.1]hept-2-ene-2-carboxylate Investigative 44434536 C14H15NO2 229.27 COC(=O)C1=C(C2CCC1N2)C3=CC=CC=C3 Ki = 2240000000000 nM Non binder T55959 Dopamine transporter BQX4B9 Methyl 2-(biphenyl-4-yl)cyclohexanecarboxylate Investigative 44429392 C20H22O2 294.4 COC(=O)[C@@H]1CCCC[C@@H]1C2=CC=C(C=C2)C3=CC=CC=C3 Ki = 830000 nM Non binder T55959 Dopamine transporter BR15OM Methyl 2-(naphthalen-2-yl)cyclohex-1-enecarboxylate Investigative 44429203 C18H18O2 266.3 COC(=O)C1=C(CCCC1)C2=CC3=CC=CC=C3C=C2 Ki = 85100000000000 nM Non binder T55959 Dopamine transporter BR53YM (2S,3S,4S,5R,6S)-3,4,5-Trihydroxy-6-[5-[(1S)-3-(methylamino)-1-thiophen-2-ylpropoxy]naphthalen-2-yl]oxyoxane-2-carboxylic acid Investigative 70685727 C24H27NO8S 489.5 CNCC[C@@H](C1=CC=CS1)OC2=CC=CC3=C2C=CC(=C3)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)O)O)O)O Ki > 10000000 nM Non binder T55959 Dopamine transporter BR6T1U Methyl 3-phenylbicyclo[2.2.1]hept-2-ene-2-carboxylate Investigative 44434529 C15H16O2 228.29 COC(=O)C1=C(C2CCC1C2)C3=CC=CC=C3 Ki = 1550000000000 nM Non binder T55959 Dopamine transporter BR9O3F Methyl 3-naphthalen-2-yl-7-azabicyclo[2.2.1]hept-2-ene-2-carboxylate Investigative 44434542 C18H17NO2 279.3 COC(=O)C1=C(C2CCC1N2)C3=CC4=CC=CC=C4C=C3 Ki = 575000000000000 nM Non binder T55959 Dopamine transporter BRP50O Methyl 3-(2,3-dichlorophenyl)bicyclo[2.2.1]hept-2-ene-2-carboxylate Investigative 44434534 C15H14Cl2O2 297.2 COC(=O)C1=C(C2CCC1C2)C3=C(C(=CC=C3)Cl)Cl Ki = 67600000000000 nM Non binder T55959 Dopamine transporter BV5C3X Methyl 2-(3-nitrophenyl)cyclohexene-1-carboxylate Investigative 44429214 C14H15NO4 261.269 COC(=O)C1=C(CCCC1)C2=CC(=CC=C2)[N+](=O)[O-] Ki = 239000 nM Non binder T55959 Dopamine transporter BVBS46 Methyl 2-(4-tert-butylphenyl)cyclohexanecarboxylate Investigative 44429393 C18H26O2 274.4 CC(C)(C)C1=CC=C(C=C1)[C@H]2CCCC[C@H]2C(=O)OC Ki = 766000 nM Non binder T55959 Dopamine transporter BVF58Z Methyl 3-(3-nitrophenyl)-7-aza-bicyclo[2.2.1]hept-2-ene-2-carboxylate Investigative 44434885 C14H14N2O4 274.27 COC(=O)C1=C(C2CCC1N2)C3=CC(=CC=C3)[N+](=O)[O-] Ki = 232000 nM Non binder T55959 Dopamine transporter BW4I1B 5-[(1S)-3-(Methylamino)-1-(thiophen-2-yl)propoxy]naphthalene-1,2-diol Investigative 44344115 C18H19NO3S 329.4 CNCC[C@@H](C1=CC=CS1)OC2=CC=CC3=C2C=CC(=C3O)O Ki = 7275000 nM Non binder T55959 Dopamine transporter BWK3E4 Methyl 2-(4-(trifluoromethyl)phenyl)cyclohexanecarboxylate Investigative 44429399 C15H17F3O2 286.29 COC(=O)[C@@H]1CCCC[C@@H]1C2=CC=C(C=C2)C(F)(F)F Ki = 222000 nM Non binder T55959 Dopamine transporter BWZ50U Methyl 2-(3,4-dichlorophenyl)cyclopent-1-enecarboxylate Investigative 44429189 C13H12Cl2O2 271.14 COC(=O)C1=C(CCC1)C2=CC(=C(C=C2)Cl)Cl Ki = 513000000000000 nM Non binder T55959 Dopamine transporter BXME98 Methyl 3-(4-chlorophenyl)bicyclo[2.2.1]hept-2-ene-2-carboxylate Investigative 44434531 C15H15ClO2 262.73 COC(=O)C1=C(C2CCC1C2)C3=CC=C(C=C3)Cl Ki = 39800000000000 nM Non binder T55959 Dopamine transporter BXMW81 Methyl 2-(4-(trifluoromethyl)phenyl)cyclohex-1-enecarboxylate Investigative 44429210 C15H15F3O2 284.27 COC(=O)C1=C(CCCC1)C2=CC=C(C=C2)C(F)(F)F Ki = 590000 nM Non binder T55959 Dopamine transporter BZ9S7Y Methyl 2-(naphthalen-2-yl)cyclohept-1-enecarboxylate Investigative 44429222 C19H20O2 280.4 COC(=O)C1=C(CCCCC1)C2=CC3=CC=CC=C3C=C2 Ki = 392000 nM Non binder T55959 Dopamine transporter D0W9JK (S)-N-isobutyl-N-(pyrrolidin-3-yl)-2-naphthamide Investigative 11220185 C19H24N2O 296.4 CC(C)CN([C@H]1CCNC1)C(=O)C2=CC3=CC=CC=C3C=C2 IC50 = 744000 nM Non binder