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39 similar compounds to monomer 50202396

Compile data set for download or QSAR
Wt: 265.8
BDBM84744
Wt: 265.8
BDBM50202381
Wt: 237.7
BDBM50202382
Wt: 279.8
BDBM50202384
Wt: 223.7
BDBM50202385
Wt: 327.8
BDBM50202386
Wt: 305.8
BDBM50202390
Wt: 265.8
BDBM50202388
Wt: 291.8
BDBM50202389
Wt: 279.8
BDBM50202392
Wt: 277.8
BDBM50202393
Wt: 279.8
BDBM50202394
Wt: 251.7
BDBM50202395
Wt: 279.8
BDBM50202397
Wt: 313.8
BDBM50202398
Displayed 1 to 15 (of 39 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 170 hits for monomerid = 84744,50202381,50202382,50202384,50202385,50202386,50202390,50202388,50202389,50202392,50202393,50202394,50202395,50202397,50202398   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Monoamine transporters; serotonin & dopamine


(Homo sapiens (Human))
BDBM50202384
PNG
((RR/SS)-2-[1-(4-chlorophenyl)-4-methylpentyl]piper...)
Show SMILES CC(C)CCC(C1CCCCN1)c1ccc(Cl)cc1
Show InChI InChI=1S/C17H26ClN/c1-13(2)6-11-16(17-5-3-4-12-19-17)14-7-9-15(18)10-8-14/h7-10,13,16-17,19H,3-6,11-12H2,1-2H3
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3.60n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human DAT expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Monoamine transporters; serotonin & dopamine


(Homo sapiens (Human))
BDBM50202388
PNG
((RR/SS)-2-[1-(4-chlorophenyl)pentyl]piperidine | (...)
Show SMILES CCCCC(C1CCCCN1)c1ccc(Cl)cc1
Show InChI InChI=1S/C16H24ClN/c1-2-3-6-15(16-7-4-5-12-18-16)13-8-10-14(17)11-9-13/h8-11,15-16,18H,2-7,12H2,1H3
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7.80n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human DAT expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Monoamine transporters; serotonin & dopamine


(Homo sapiens (Human))
BDBM50202389
PNG
((RR/SS)-2-[1-(4-chlorophenyl)-2-cyclopentylethyl]-...)
Show SMILES Clc1ccc(cc1)C(CC1CCCC1)C1CCCCN1
Show InChI InChI=1S/C18H26ClN/c19-16-10-8-15(9-11-16)17(13-14-5-1-2-6-14)18-7-3-4-12-20-18/h8-11,14,17-18,20H,1-7,12-13H2
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9.40n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human DAT expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Monoamine transporters; serotonin & dopamine


(Homo sapiens (Human))
BDBM50202395
PNG
((RS/SR)-2-[1-(4-chlorophenyl)butyl]piperidine | CH...)
Show SMILES CCCC(C1CCCCN1)c1ccc(Cl)cc1
Show InChI InChI=1S/C15H22ClN/c1-2-5-14(15-6-3-4-11-17-15)12-7-9-13(16)10-8-12/h7-10,14-15,17H,2-6,11H2,1H3
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11n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human DAT expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Monoamine transporters; serotonin & dopamine


(Homo sapiens (Human))
BDBM50202381
PNG
((RR/SS)-2-[1-(4-chlorophenyl)-3-methylbutyl]pipero...)
Show SMILES CC(C)CC(C1CCCCN1)c1ccc(Cl)cc1
Show InChI InChI=1S/C16H24ClN/c1-12(2)11-15(16-5-3-4-10-18-16)13-6-8-14(17)9-7-13/h6-9,12,15-16,18H,3-5,10-11H2,1-2H3
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16n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human DAT expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM84744
PNG
(BTS 54 354 | BTS-54354 | DESMETHYLSIBUTRAMINE)
Show SMILES CNC(CC(C)C)C1(CCC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C16H24ClN/c1-12(2)11-15(18-3)16(9-4-10-16)13-5-7-14(17)8-6-13/h5-8,12,15,18H,4,9-11H2,1-3H3
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18.2n/an/an/an/an/an/an/an/a



Boots Pharmaceuticals

Curated by PDSP Ki Database




Neuropharmacology 32: 737-43 (1993)


BindingDB Entry DOI: 10.7270/Q22J69D4
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM84744
PNG
(BTS 54 354 | BTS-54354 | DESMETHYLSIBUTRAMINE)
Show SMILES CNC(CC(C)C)C1(CCC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C16H24ClN/c1-12(2)11-15(18-3)16(9-4-10-16)13-5-7-14(17)8-6-13/h5-8,12,15,18H,4,9-11H2,1-3H3
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19.3n/an/an/an/an/an/an/an/a



Boots Pharmaceuticals

Curated by PDSP Ki Database




Neuropharmacology 32: 737-43 (1993)


BindingDB Entry DOI: 10.7270/Q22J69D4
More data for this
Ligand-Target Pair
Monoamine transporters; serotonin & dopamine


(Homo sapiens (Human))
BDBM50202394
PNG
((RR/SS)-2-[1-(4-chlorophenyl)hexyl]piperidine | (R...)
Show SMILES CCCCCC(C1CCCCN1)c1ccc(Cl)cc1
Show InChI InChI=1S/C17H26ClN/c1-2-3-4-7-16(17-8-5-6-13-19-17)14-9-11-15(18)12-10-14/h9-12,16-17,19H,2-8,13H2,1H3
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23n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human DAT expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Monoamine transporters; serotonin & dopamine


(Homo sapiens (Human))
BDBM50202398
PNG
((RR/SS)-2-[1-(4-chlorophenyl)-3-phenylpropyl]piper...)
Show SMILES Clc1ccc(cc1)C(CCc1ccccc1)C1CCCCN1
Show InChI InChI=1S/C20H24ClN/c21-18-12-10-17(11-13-18)19(20-8-4-5-15-22-20)14-9-16-6-2-1-3-7-16/h1-3,6-7,10-13,19-20,22H,4-5,8-9,14-15H2
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24n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human DAT expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Monoamine transporters; serotonin & dopamine


(Homo sapiens (Human))
BDBM50202393
PNG
((RR/SS)-2-[(4-chlorophenyl)cyclopentylmethyl]-pipe...)
Show SMILES Clc1ccc(cc1)C(C1CCCC1)C1CCCCN1
Show InChI InChI=1S/C17H24ClN/c18-15-10-8-14(9-11-15)17(13-5-1-2-6-13)16-7-3-4-12-19-16/h8-11,13,16-17,19H,1-7,12H2
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36n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human DAT expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Monoamine transporters; serotonin & dopamine


(Homo sapiens (Human))
BDBM50202382
PNG
((RR/SS)-2-[1-(4-chlorophenyl)propyl]piperidine | (...)
Show SMILES CCC(C1CCCCN1)c1ccc(Cl)cc1
Show InChI InChI=1S/C14H20ClN/c1-2-13(14-5-3-4-10-16-14)11-6-8-12(15)9-7-11/h6-9,13-14,16H,2-5,10H2,1H3
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37n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human DAT expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Monoamine transporters; serotonin & dopamine


(Homo sapiens (Human))
BDBM50202397
PNG
((RR/SS)-2-[1-(4-chlorophenyl)-3,3-dimethylbutyl]-p...)
Show SMILES CC(C)(C)CC(C1CCCCN1)c1ccc(Cl)cc1
Show InChI InChI=1S/C17H26ClN/c1-17(2,3)12-15(16-6-4-5-11-19-16)13-7-9-14(18)10-8-13/h7-10,15-16,19H,4-6,11-12H2,1-3H3
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120n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human DAT expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Monoamine transporters; serotonin & dopamine


(Homo sapiens (Human))
BDBM50202390
PNG
((RR/SS)-2-[1-(4-chlorophenyl)-2-cyclohexylethyl]-p...)
Show SMILES Clc1ccc(cc1)C(CC1CCCCC1)C1CCCCN1
Show InChI InChI=1S/C19H28ClN/c20-17-11-9-16(10-12-17)18(19-8-4-5-13-21-19)14-15-6-2-1-3-7-15/h9-12,15,18-19,21H,1-8,13-14H2
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130n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human DAT expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM50202394
PNG
((RR/SS)-2-[1-(4-chlorophenyl)hexyl]piperidine | (R...)
Show SMILES CCCCCC(C1CCCCN1)c1ccc(Cl)cc1
Show InChI InChI=1S/C17H26ClN/c1-2-3-4-7-16(17-8-5-6-13-19-17)14-9-11-15(18)12-10-14/h9-12,16-17,19H,2-8,13H2,1H3
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160n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human NET expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Monoamine transporters; serotonin & dopamine


(Homo sapiens (Human))
BDBM50202381
PNG
((RR/SS)-2-[1-(4-chlorophenyl)-3-methylbutyl]pipero...)
Show SMILES CC(C)CC(C1CCCCN1)c1ccc(Cl)cc1
Show InChI InChI=1S/C16H24ClN/c1-12(2)11-15(16-5-3-4-10-18-16)13-6-8-14(17)9-7-13/h6-9,12,15-16,18H,3-5,10-11H2,1-2H3
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170n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human DAT expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Monoamine transporters; serotonin & dopamine


(Homo sapiens (Human))
BDBM50202385
PNG
((RR/SS)-2-(1-(4-chlorophenyl)ethyl)piperidine | (R...)
Show SMILES CC(C1CCCCN1)c1ccc(Cl)cc1
Show InChI InChI=1S/C13H18ClN/c1-10(13-4-2-3-9-15-13)11-5-7-12(14)8-6-11/h5-8,10,13,15H,2-4,9H2,1H3
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180n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human DAT expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM50202395
PNG
((RS/SR)-2-[1-(4-chlorophenyl)butyl]piperidine | CH...)
Show SMILES CCCC(C1CCCCN1)c1ccc(Cl)cc1
Show InChI InChI=1S/C15H22ClN/c1-2-5-14(15-6-3-4-11-17-15)12-7-9-13(16)10-8-12/h7-10,14-15,17H,2-6,11H2,1H3
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200n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human NET expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM50202388
PNG
((RR/SS)-2-[1-(4-chlorophenyl)pentyl]piperidine | (...)
Show SMILES CCCCC(C1CCCCN1)c1ccc(Cl)cc1
Show InChI InChI=1S/C16H24ClN/c1-2-3-6-15(16-7-4-5-12-18-16)13-8-10-14(17)11-9-13/h8-11,15-16,18H,2-7,12H2,1H3
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230n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human NET expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Monoamine transporters; serotonin & dopamine


(Homo sapiens (Human))
BDBM50202390
PNG
((RR/SS)-2-[1-(4-chlorophenyl)-2-cyclohexylethyl]-p...)
Show SMILES Clc1ccc(cc1)C(CC1CCCCC1)C1CCCCN1
Show InChI InChI=1S/C19H28ClN/c20-17-11-9-16(10-12-17)18(19-8-4-5-13-21-19)14-15-6-2-1-3-7-15/h9-12,15,18-19,21H,1-8,13-14H2
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260n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human DAT expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Monoamine transporters; serotonin & dopamine


(Homo sapiens (Human))
BDBM50202388
PNG
((RR/SS)-2-[1-(4-chlorophenyl)pentyl]piperidine | (...)
Show SMILES CCCCC(C1CCCCN1)c1ccc(Cl)cc1
Show InChI InChI=1S/C16H24ClN/c1-2-3-6-15(16-7-4-5-12-18-16)13-8-10-14(17)11-9-13/h8-11,15-16,18H,2-7,12H2,1H3
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290n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human DAT expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Monoamine transporters; serotonin & dopamine


(Homo sapiens (Human))
BDBM50202389
PNG
((RR/SS)-2-[1-(4-chlorophenyl)-2-cyclopentylethyl]-...)
Show SMILES Clc1ccc(cc1)C(CC1CCCC1)C1CCCCN1
Show InChI InChI=1S/C18H26ClN/c19-16-10-8-15(9-11-16)17(13-14-5-1-2-6-14)18-7-3-4-12-20-18/h8-11,14,17-18,20H,1-7,12-13H2
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310n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human DAT expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM50202382
PNG
((RR/SS)-2-[1-(4-chlorophenyl)propyl]piperidine | (...)
Show SMILES CCC(C1CCCCN1)c1ccc(Cl)cc1
Show InChI InChI=1S/C14H20ClN/c1-2-13(14-5-3-4-10-16-14)11-6-8-12(15)9-7-11/h6-9,13-14,16H,2-5,10H2,1H3
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360n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human NET expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM50202385
PNG
((RR/SS)-2-(1-(4-chlorophenyl)ethyl)piperidine | (R...)
Show SMILES CC(C1CCCCN1)c1ccc(Cl)cc1
Show InChI InChI=1S/C13H18ClN/c1-10(13-4-2-3-9-15-13)11-5-7-12(14)8-6-11/h5-8,10,13,15H,2-4,9H2,1H3
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360n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human NET expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Monoamine transporters; serotonin & dopamine


(Homo sapiens (Human))
BDBM50202395
PNG
((RS/SR)-2-[1-(4-chlorophenyl)butyl]piperidine | CH...)
Show SMILES CCCC(C1CCCCN1)c1ccc(Cl)cc1
Show InChI InChI=1S/C15H22ClN/c1-2-5-14(15-6-3-4-11-17-15)12-7-9-13(16)10-8-12/h7-10,14-15,17H,2-6,11H2,1H3
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380n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human DAT expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM50202393
PNG
((RR/SS)-2-[(4-chlorophenyl)cyclopentylmethyl]-pipe...)
Show SMILES Clc1ccc(cc1)C(C1CCCC1)C1CCCCN1
Show InChI InChI=1S/C17H24ClN/c18-15-10-8-14(9-11-15)17(13-5-1-2-6-13)16-7-3-4-12-19-16/h8-11,13,16-17,19H,1-7,12H2
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380n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human NET expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Monoamine transporters; serotonin & dopamine


(Homo sapiens (Human))
BDBM50202392
PNG
((RR/SS)-2-[1-(4-chlorophenyl)-2-ethylbutyl]piperid...)
Show SMILES CCC(CC)C(C1CCCCN1)c1ccc(Cl)cc1
Show InChI InChI=1S/C17H26ClN/c1-3-13(4-2)17(16-7-5-6-12-19-16)14-8-10-15(18)11-9-14/h8-11,13,16-17,19H,3-7,12H2,1-2H3
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400n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human DAT expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Monoamine transporters; serotonin & dopamine


(Homo sapiens (Human))
BDBM50202386
PNG
((RR/SS)-2-[1-(4-chlorophenyl)-4-phenylbutyl]piperi...)
Show SMILES Clc1ccc(cc1)C(CCCc1ccccc1)C1CCCCN1
Show InChI InChI=1S/C21H26ClN/c22-19-14-12-18(13-15-19)20(21-11-4-5-16-23-21)10-6-9-17-7-2-1-3-8-17/h1-3,7-8,12-15,20-21,23H,4-6,9-11,16H2
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440n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human DAT expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM50202386
PNG
((RR/SS)-2-[1-(4-chlorophenyl)-4-phenylbutyl]piperi...)
Show SMILES Clc1ccc(cc1)C(CCCc1ccccc1)C1CCCCN1
Show InChI InChI=1S/C21H26ClN/c22-19-14-12-18(13-15-19)20(21-11-4-5-16-23-21)10-6-9-17-7-2-1-3-8-17/h1-3,7-8,12-15,20-21,23H,4-6,9-11,16H2
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490n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human NET expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Monoamine transporters; serotonin & dopamine


(Homo sapiens (Human))
BDBM50202384
PNG
((RR/SS)-2-[1-(4-chlorophenyl)-4-methylpentyl]piper...)
Show SMILES CC(C)CCC(C1CCCCN1)c1ccc(Cl)cc1
Show InChI InChI=1S/C17H26ClN/c1-13(2)6-11-16(17-5-3-4-12-19-17)14-7-9-15(18)10-8-14/h7-10,13,16-17,19H,3-6,11-12H2,1-2H3
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510n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human DAT expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Monoamine transporters; serotonin & dopamine


(Homo sapiens (Human))
BDBM50202397
PNG
((RR/SS)-2-[1-(4-chlorophenyl)-3,3-dimethylbutyl]-p...)
Show SMILES CC(C)(C)CC(C1CCCCN1)c1ccc(Cl)cc1
Show InChI InChI=1S/C17H26ClN/c1-17(2,3)12-15(16-6-4-5-11-19-16)13-7-9-14(18)10-8-13/h7-10,15-16,19H,4-6,11-12H2,1-3H3
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600n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human DAT expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (Human))
BDBM50202398
PNG
((RR/SS)-2-[1-(4-chlorophenyl)-3-phenylpropyl]piper...)
Show SMILES Clc1ccc(cc1)C(CCc1ccccc1)C1CCCCN1
Show InChI InChI=1S/C20H24ClN/c21-18-12-10-17(11-13-18)19(20-8-4-5-15-22-20)14-9-16-6-2-1-3-7-16/h1-3,6-7,10-13,19-20,22H,4-5,8-9,14-15H2
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640n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human SERT expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Monoamine transporters; serotonin & dopamine


(Homo sapiens (Human))
BDBM50202393
PNG
((RR/SS)-2-[(4-chlorophenyl)cyclopentylmethyl]-pipe...)
Show SMILES Clc1ccc(cc1)C(C1CCCC1)C1CCCCN1
Show InChI InChI=1S/C17H24ClN/c18-15-10-8-14(9-11-15)17(13-5-1-2-6-13)16-7-3-4-12-19-16/h8-11,13,16-17,19H,1-7,12H2
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690n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human DAT expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (Human))
BDBM50202386
PNG
((RR/SS)-2-[1-(4-chlorophenyl)-4-phenylbutyl]piperi...)
Show SMILES Clc1ccc(cc1)C(CCCc1ccccc1)C1CCCCN1
Show InChI InChI=1S/C21H26ClN/c22-19-14-12-18(13-15-19)20(21-11-4-5-16-23-21)10-6-9-17-7-2-1-3-8-17/h1-3,7-8,12-15,20-21,23H,4-6,9-11,16H2
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700n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human SERT expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Monoamine transporters; serotonin & dopamine


(Homo sapiens (Human))
BDBM50202398
PNG
((RR/SS)-2-[1-(4-chlorophenyl)-3-phenylpropyl]piper...)
Show SMILES Clc1ccc(cc1)C(CCc1ccccc1)C1CCCCN1
Show InChI InChI=1S/C20H24ClN/c21-18-12-10-17(11-13-18)19(20-8-4-5-15-22-20)14-9-16-6-2-1-3-7-16/h1-3,6-7,10-13,19-20,22H,4-5,8-9,14-15H2
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700n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human DAT expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM50202384
PNG
((RR/SS)-2-[1-(4-chlorophenyl)-4-methylpentyl]piper...)
Show SMILES CC(C)CCC(C1CCCCN1)c1ccc(Cl)cc1
Show InChI InChI=1S/C17H26ClN/c1-13(2)6-11-16(17-5-3-4-12-19-17)14-7-9-15(18)10-8-14/h7-10,13,16-17,19H,3-6,11-12H2,1-2H3
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830n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human NET expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM50202381
PNG
((RR/SS)-2-[1-(4-chlorophenyl)-3-methylbutyl]pipero...)
Show SMILES CC(C)CC(C1CCCCN1)c1ccc(Cl)cc1
Show InChI InChI=1S/C16H24ClN/c1-12(2)11-15(16-5-3-4-10-18-16)13-6-8-14(17)9-7-13/h6-9,12,15-16,18H,3-5,10-11H2,1-2H3
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840n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human NET expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Monoamine transporters; serotonin & dopamine


(Homo sapiens (Human))
BDBM50202394
PNG
((RR/SS)-2-[1-(4-chlorophenyl)hexyl]piperidine | (R...)
Show SMILES CCCCCC(C1CCCCN1)c1ccc(Cl)cc1
Show InChI InChI=1S/C17H26ClN/c1-2-3-4-7-16(17-8-5-6-13-19-17)14-9-11-15(18)12-10-14/h9-12,16-17,19H,2-8,13H2,1H3
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870n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human DAT expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (Human))
BDBM50202390
PNG
((RR/SS)-2-[1-(4-chlorophenyl)-2-cyclohexylethyl]-p...)
Show SMILES Clc1ccc(cc1)C(CC1CCCCC1)C1CCCCN1
Show InChI InChI=1S/C19H28ClN/c20-17-11-9-16(10-12-17)18(19-8-4-5-13-21-19)14-15-6-2-1-3-7-15/h9-12,15,18-19,21H,1-8,13-14H2
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900n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human SERT expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM50202392
PNG
((RR/SS)-2-[1-(4-chlorophenyl)-2-ethylbutyl]piperid...)
Show SMILES CCC(CC)C(C1CCCCN1)c1ccc(Cl)cc1
Show InChI InChI=1S/C17H26ClN/c1-3-13(4-2)17(16-7-5-6-12-19-16)14-8-10-15(18)11-9-14/h8-11,13,16-17,19H,3-7,12H2,1-2H3
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970n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human NET expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM50202395
PNG
((RS/SR)-2-[1-(4-chlorophenyl)butyl]piperidine | CH...)
Show SMILES CCCC(C1CCCCN1)c1ccc(Cl)cc1
Show InChI InChI=1S/C15H22ClN/c1-2-5-14(15-6-3-4-11-17-15)12-7-9-13(16)10-8-12/h7-10,14-15,17H,2-6,11H2,1H3
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1.40E+3n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human NET expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM50202397
PNG
((RR/SS)-2-[1-(4-chlorophenyl)-3,3-dimethylbutyl]-p...)
Show SMILES CC(C)(C)CC(C1CCCCN1)c1ccc(Cl)cc1
Show InChI InChI=1S/C17H26ClN/c1-17(2,3)12-15(16-6-4-5-11-19-16)13-7-9-14(18)10-8-13/h7-10,15-16,19H,4-6,11-12H2,1-3H3
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1.40E+3n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human NET expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM50202386
PNG
((RR/SS)-2-[1-(4-chlorophenyl)-4-phenylbutyl]piperi...)
Show SMILES Clc1ccc(cc1)C(CCCc1ccccc1)C1CCCCN1
Show InChI InChI=1S/C21H26ClN/c22-19-14-12-18(13-15-19)20(21-11-4-5-16-23-21)10-6-9-17-7-2-1-3-8-17/h1-3,7-8,12-15,20-21,23H,4-6,9-11,16H2
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1.50E+3n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human NET expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (Human))
BDBM50202386
PNG
((RR/SS)-2-[1-(4-chlorophenyl)-4-phenylbutyl]piperi...)
Show SMILES Clc1ccc(cc1)C(CCCc1ccccc1)C1CCCCN1
Show InChI InChI=1S/C21H26ClN/c22-19-14-12-18(13-15-19)20(21-11-4-5-16-23-21)10-6-9-17-7-2-1-3-8-17/h1-3,7-8,12-15,20-21,23H,4-6,9-11,16H2
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1.50E+3n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human SERT expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM50202394
PNG
((RR/SS)-2-[1-(4-chlorophenyl)hexyl]piperidine | (R...)
Show SMILES CCCCCC(C1CCCCN1)c1ccc(Cl)cc1
Show InChI InChI=1S/C17H26ClN/c1-2-3-4-7-16(17-8-5-6-13-19-17)14-9-11-15(18)12-10-14/h9-12,16-17,19H,2-8,13H2,1H3
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1.50E+3n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human NET expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM50202388
PNG
((RR/SS)-2-[1-(4-chlorophenyl)pentyl]piperidine | (...)
Show SMILES CCCCC(C1CCCCN1)c1ccc(Cl)cc1
Show InChI InChI=1S/C16H24ClN/c1-2-3-6-15(16-7-4-5-12-18-16)13-8-10-14(17)11-9-13/h8-11,15-16,18H,2-7,12H2,1H3
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1.60E+3n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human NET expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM50202389
PNG
((RR/SS)-2-[1-(4-chlorophenyl)-2-cyclopentylethyl]-...)
Show SMILES Clc1ccc(cc1)C(CC1CCCC1)C1CCCCN1
Show InChI InChI=1S/C18H26ClN/c19-16-10-8-15(9-11-16)17(13-14-5-1-2-6-14)18-7-3-4-12-20-18/h8-11,14,17-18,20H,1-7,12-13H2
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1.70E+3n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human NET expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM50202398
PNG
((RR/SS)-2-[1-(4-chlorophenyl)-3-phenylpropyl]piper...)
Show SMILES Clc1ccc(cc1)C(CCc1ccccc1)C1CCCCN1
Show InChI InChI=1S/C20H24ClN/c21-18-12-10-17(11-13-18)19(20-8-4-5-15-22-20)14-9-16-6-2-1-3-7-16/h1-3,6-7,10-13,19-20,22H,4-5,8-9,14-15H2
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1.80E+3n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human NET expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Monoamine transporters; serotonin & dopamine


(Homo sapiens (Human))
BDBM50202382
PNG
((RR/SS)-2-[1-(4-chlorophenyl)propyl]piperidine | (...)
Show SMILES CCC(C1CCCCN1)c1ccc(Cl)cc1
Show InChI InChI=1S/C14H20ClN/c1-2-13(14-5-3-4-10-16-14)11-6-8-12(15)9-7-11/h6-9,13-14,16H,2-5,10H2,1H3
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1.80E+3n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human DAT expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (Human))
BDBM50202398
PNG
((RR/SS)-2-[1-(4-chlorophenyl)-3-phenylpropyl]piper...)
Show SMILES Clc1ccc(cc1)C(CCc1ccccc1)C1CCCCN1
Show InChI InChI=1S/C20H24ClN/c21-18-12-10-17(11-13-18)19(20-8-4-5-15-22-20)14-9-16-6-2-1-3-7-16/h1-3,6-7,10-13,19-20,22H,4-5,8-9,14-15H2
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1.80E+3n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human SERT expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (Human))
BDBM50202394
PNG
((RR/SS)-2-[1-(4-chlorophenyl)hexyl]piperidine | (R...)
Show SMILES CCCCCC(C1CCCCN1)c1ccc(Cl)cc1
Show InChI InChI=1S/C17H26ClN/c1-2-3-4-7-16(17-8-5-6-13-19-17)14-9-11-15(18)12-10-14/h9-12,16-17,19H,2-8,13H2,1H3
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2.20E+3n/an/an/an/an/an/an/an/a



Massachusetts College of Pharmacy and Health Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI-55 from human SERT expressing HEK293 cells


J Med Chem 50: 219-32 (2007)


Article DOI: 10.1021/jm0608614
BindingDB Entry DOI: 10.7270/Q2PN96F3
More data for this
Ligand-Target Pair
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