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Compile Data Set for Download or QSAR

Found 62 hits Enz. Inhib. hit(s) with all data for entry = 50038713   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50254113
PNG
((R)-4-(3,4-dichlorophenyl)-4-(1H-indol-4-yl)-N-met...)
Show SMILES CNCCC[C@H](c1ccc(Cl)c(Cl)c1)c1cccc2[nH]ccc12 |r|
Show InChI InChI=1S/C19H20Cl2N2/c1-22-10-3-5-14(13-7-8-17(20)18(21)12-13)15-4-2-6-19-16(15)9-11-23-19/h2,4,6-9,11-12,14,22-23H,3,5,10H2,1H3/t14-/m1/s1
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0.820n/an/an/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [3H]citalopram from SERT in Sprague-dawley rat frontal cortex by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50254027
PNG
((R)-3-(3,4-dichlorophenyl)-3-(1H-indol-4-yl)-N-met...)
Show SMILES CNCC[C@H](c1ccc(Cl)c(Cl)c1)c1cccc2[nH]ccc12 |r|
Show InChI InChI=1S/C18H18Cl2N2/c1-21-9-7-13(12-5-6-16(19)17(20)11-12)14-3-2-4-18-15(14)8-10-22-18/h2-6,8,10-11,13,21-22H,7,9H2,1H3/t13-/m1/s1
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1.68n/an/an/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [3H]citalopram from SERT in Sprague-dawley rat frontal cortex by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50254112
PNG
((S)-4-(1-(3,4-dimethylphenyl)hexyl)-1H-indene hydr...)
Show SMILES CNCCC[C@@H](c1ccc(Cl)c(Cl)c1)c1cccc2[nH]ccc12 |r|
Show InChI InChI=1S/C19H20Cl2N2/c1-22-10-3-5-14(13-7-8-17(20)18(21)12-13)15-4-2-6-19-16(15)9-11-23-19/h2,4,6-9,11-12,14,22-23H,3,5,10H2,1H3/t14-/m0/s1
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2.72n/an/an/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [3H]citalopram from SERT in Sprague-dawley rat frontal cortex by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50254111
PNG
((S)-3-(3,4-dichlorophenyl)-3-(1H-indol-4-yl)-N-met...)
Show SMILES CNCC[C@@H](c1ccc(Cl)c(Cl)c1)c1cccc2[nH]ccc12 |r|
Show InChI InChI=1S/C18H18Cl2N2/c1-21-9-7-13(12-5-6-16(19)17(20)11-12)14-3-2-4-18-15(14)8-10-22-18/h2-6,8,10-11,13,21-22H,7,9H2,1H3/t13-/m0/s1
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3.63n/an/an/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [3H]citalopram from SERT in Sprague-dawley rat frontal cortex by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Transporter


(Rattus norvegicus (rat))
BDBM50366567
PNG
(ATOMOXETINE)
Show SMILES CNCC[C@@H](Oc1ccccc1C)c1ccccc1 |r|
Show InChI InChI=1S/C17H21NO/c1-14-8-6-7-11-16(14)19-17(12-13-18-2)15-9-4-3-5-10-15/h3-11,17-18H,12-13H2,1-2H3/t17-/m1/s1
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4n/an/an/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [3H]nisoxetine from Sprague-dawley rat NET by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50254110
PNG
((R)-4-(3,4-dichlorophenyl)-N-methyl-4-(naphthalen-...)
Show SMILES CNCCC[C@H](c1ccc(Cl)c(Cl)c1)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C21H21Cl2N/c1-24-13-5-10-18(16-11-12-20(22)21(23)14-16)19-9-4-7-15-6-2-3-8-17(15)19/h2-4,6-9,11-12,14,18,24H,5,10,13H2,1H3/t18-/m1/s1
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4.10n/an/an/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [3H]citalopram from SERT in Sprague-dawley rat frontal cortex by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM84745
PNG
(CAS_136434-34-9 | DULOXETINE | LY-248686 | LY24868...)
Show SMILES CNCC[C@H](Oc1cccc2ccccc12)c1cccs1 |r|
Show InChI InChI=1S/C18H19NOS/c1-19-12-11-17(18-10-5-13-21-18)20-16-9-4-7-14-6-2-3-8-15(14)16/h2-10,13,17,19H,11-12H2,1H3/t17-/m0/s1
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4.60n/an/an/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [3H]citalopram from SERT in Sprague-dawley rat frontal cortex by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50254075
PNG
((R)-3-(3,4-dichlorophenyl)-N-methyl-3-(naphthalen-...)
Show SMILES CNCC[C@H](c1ccc(Cl)c(Cl)c1)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C20H19Cl2N/c1-23-12-11-17(15-9-10-19(21)20(22)13-15)18-8-4-6-14-5-2-3-7-16(14)18/h2-10,13,17,23H,11-12H2,1H3/t17-/m1/s1
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5.30n/an/an/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [3H]citalopram from SERT in Sprague-dawley rat frontal cortex by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Transporter


(Rattus norvegicus (rat))
BDBM22417
PNG
(3-(2-methoxyphenoxy)-N-methyl-3-phenylpropan-1-ami...)
Show SMILES CNCCC(Oc1ccccc1OC)c1ccccc1
Show InChI InChI=1S/C17H21NO2/c1-18-13-12-15(14-8-4-3-5-9-14)20-17-11-7-6-10-16(17)19-2/h3-11,15,18H,12-13H2,1-2H3
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6n/an/an/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [3H]nisoxetine from Sprague-dawley rat NET by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Transporter


(Rattus norvegicus (rat))
BDBM50254049
PNG
((S)-N-methyl-4-(naphthalen-1-yl)-4-(thiophen-2-yl)...)
Show SMILES CNCCC[C@H](c1cccs1)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C19H21NS/c1-20-13-5-11-18(19-12-6-14-21-19)17-10-4-8-15-7-2-3-9-16(15)17/h2-4,6-10,12,14,18,20H,5,11,13H2,1H3/t18-/m0/s1
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7.90n/an/an/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [3H]nisoxetine from Sprague-dawley rat NET by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50136674
PNG
((3R)-N-methyl-3-(1-naphthyloxy)-3-(2-thienyl)propa...)
Show SMILES CNCC[C@@H](Oc1cccc2ccccc12)c1cccs1 |r|
Show InChI InChI=1S/C18H19NOS/c1-19-12-11-17(18-10-5-13-21-18)20-16-9-4-7-14-6-2-3-8-15(14)16/h2-10,13,17,19H,11-12H2,1H3/t17-/m1/s1
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8.80n/an/an/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [3H]citalopram from SERT in Sprague-dawley rat frontal cortex by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Transporter


(Rattus norvegicus (rat))
BDBM50254073
PNG
((S)-4-(1H-indol-4-yl)-N-methyl-4-(thiophen-2-yl)bu...)
Show SMILES CNCCC[C@H](c1cccs1)c1cccc2[nH]ccc12 |r|
Show InChI InChI=1S/C17H20N2S/c1-18-10-3-6-15(17-8-4-12-20-17)13-5-2-7-16-14(13)9-11-19-16/h2,4-5,7-9,11-12,15,18-19H,3,6,10H2,1H3/t15-/m0/s1
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9n/an/an/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [3H]nisoxetine from Sprague-dawley rat NET by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50254048
PNG
((R)-N-methyl-4-(naphthalen-1-yl)-4-(thiophen-2-yl)...)
Show SMILES CNCCC[C@@H](c1cccs1)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C19H21NS/c1-20-13-5-11-18(19-12-6-14-21-19)17-10-4-8-15-7-2-3-9-16(15)17/h2-4,6-10,12,14,18,20H,5,11,13H2,1H3/t18-/m1/s1
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9.5n/an/an/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [3H]citalopram from SERT in Sprague-dawley rat frontal cortex by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50254046
PNG
((R)-N-methyl-3-(naphthalen-1-yl)-3-(thiophen-2-yl)...)
Show SMILES CNCC[C@@H](c1cccs1)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C18H19NS/c1-19-12-11-17(18-10-5-13-20-18)16-9-4-7-14-6-2-3-8-15(14)16/h2-10,13,17,19H,11-12H2,1H3/t17-/m1/s1
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12.1n/an/an/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [3H]citalopram from SERT in Sprague-dawley rat frontal cortex by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Transporter


(Rattus norvegicus (rat))
BDBM50254071
PNG
((S)-3-(1H-indol-4-yl)-N-methyl-3-(thiophen-2-yl)pr...)
Show SMILES CNCC[C@H](c1cccs1)c1cccc2[nH]ccc12 |r|
Show InChI InChI=1S/C16H18N2S/c1-17-9-7-14(16-6-3-11-19-16)12-4-2-5-15-13(12)8-10-18-15/h2-6,8,10-11,14,17-18H,7,9H2,1H3/t14-/m0/s1
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13.8n/an/an/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [3H]nisoxetine from Sprague-dawley rat NET by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Transporter


(Rattus norvegicus (rat))
BDBM50136674
PNG
((3R)-N-methyl-3-(1-naphthyloxy)-3-(2-thienyl)propa...)
Show SMILES CNCC[C@@H](Oc1cccc2ccccc12)c1cccs1 |r|
Show InChI InChI=1S/C18H19NOS/c1-19-12-11-17(18-10-5-13-21-18)20-16-9-4-7-14-6-2-3-8-15(14)16/h2-10,13,17,19H,11-12H2,1H3/t17-/m1/s1
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16n/an/an/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [3H]nisoxetine from Sprague-dawley rat NET by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Transporter


(Rattus norvegicus (rat))
BDBM84745
PNG
(CAS_136434-34-9 | DULOXETINE | LY-248686 | LY24868...)
Show SMILES CNCC[C@H](Oc1cccc2ccccc12)c1cccs1 |r|
Show InChI InChI=1S/C18H19NOS/c1-19-12-11-17(18-10-5-13-21-18)20-16-9-4-7-14-6-2-3-8-15(14)16/h2-10,13,17,19H,11-12H2,1H3/t17-/m0/s1
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16n/an/an/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [3H]nisoxetine from Sprague-dawley rat NET by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50254047
PNG
((S)-N-methyl-3-(naphthalen-1-yl)-3-(thiophen-2-yl)...)
Show SMILES CNCC[C@H](c1cccs1)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C18H19NS/c1-19-12-11-17(18-10-5-13-20-18)16-9-4-7-14-6-2-3-8-15(14)16/h2-10,13,17,19H,11-12H2,1H3/t17-/m0/s1
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30.2n/an/an/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [3H]citalopram from SERT in Sprague-dawley rat frontal cortex by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50254071
PNG
((S)-3-(1H-indol-4-yl)-N-methyl-3-(thiophen-2-yl)pr...)
Show SMILES CNCC[C@H](c1cccs1)c1cccc2[nH]ccc12 |r|
Show InChI InChI=1S/C16H18N2S/c1-17-9-7-14(16-6-3-11-19-16)12-4-2-5-15-13(12)8-10-18-15/h2-6,8,10-11,14,17-18H,7,9H2,1H3/t14-/m0/s1
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31.9n/an/an/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [3H]citalopram from SERT in Sprague-dawley rat frontal cortex by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Transporter


(Rattus norvegicus (rat))
BDBM50254111
PNG
((S)-3-(3,4-dichlorophenyl)-3-(1H-indol-4-yl)-N-met...)
Show SMILES CNCC[C@@H](c1ccc(Cl)c(Cl)c1)c1cccc2[nH]ccc12 |r|
Show InChI InChI=1S/C18H18Cl2N2/c1-21-9-7-13(12-5-6-16(19)17(20)11-12)14-3-2-4-18-15(14)8-10-22-18/h2-6,8,10-11,13,21-22H,7,9H2,1H3/t13-/m0/s1
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35.4n/an/an/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [3H]nisoxetine from Sprague-dawley rat NET by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50254049
PNG
((S)-N-methyl-4-(naphthalen-1-yl)-4-(thiophen-2-yl)...)
Show SMILES CNCCC[C@H](c1cccs1)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C19H21NS/c1-20-13-5-11-18(19-12-6-14-21-19)17-10-4-8-15-7-2-3-9-16(15)17/h2-4,6-10,12,14,18,20H,5,11,13H2,1H3/t18-/m0/s1
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39.7n/an/an/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [3H]citalopram from SERT in Sprague-dawley rat frontal cortex by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM30130
PNG
(CHEMBL1201082 | CHEMBL41 | Fluoxetin | Fluoxetine ...)
Show SMILES CNCCC(Oc1ccc(cc1)C(F)(F)F)c1ccccc1
Show InChI InChI=1S/C17H18F3NO/c1-21-12-11-16(13-5-3-2-4-6-13)22-15-9-7-14(8-10-15)17(18,19)20/h2-10,16,21H,11-12H2,1H3
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48n/an/an/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [3H]citalopram from SERT in Sprague-dawley rat frontal cortex by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50254076
PNG
((S)-4-(3,4-dichlorophenyl)-N-methyl-4-(naphthalen-...)
Show SMILES CNCCC[C@@H](c1ccc(Cl)c(Cl)c1)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C21H21Cl2N/c1-24-13-5-10-18(16-11-12-20(22)21(23)14-16)19-9-4-7-15-6-2-3-8-17(15)19/h2-4,6-9,11-12,14,18,24H,5,10,13H2,1H3/t18-/m0/s1
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49.9n/an/an/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [3H]citalopram from SERT in Sprague-dawley rat frontal cortex by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Transporter


(Rattus norvegicus (rat))
BDBM50254047
PNG
((S)-N-methyl-3-(naphthalen-1-yl)-3-(thiophen-2-yl)...)
Show SMILES CNCC[C@H](c1cccs1)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C18H19NS/c1-19-12-11-17(18-10-5-13-20-18)16-9-4-7-14-6-2-3-8-15(14)16/h2-10,13,17,19H,11-12H2,1H3/t17-/m0/s1
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52.1n/an/an/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [3H]nisoxetine from Sprague-dawley rat NET by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50254073
PNG
((S)-4-(1H-indol-4-yl)-N-methyl-4-(thiophen-2-yl)bu...)
Show SMILES CNCCC[C@H](c1cccs1)c1cccc2[nH]ccc12 |r|
Show InChI InChI=1S/C17H20N2S/c1-18-10-3-6-15(17-8-4-12-20-17)13-5-2-7-16-14(13)9-11-19-16/h2,4-5,7-9,11-12,15,18-19H,3,6,10H2,1H3/t15-/m0/s1
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72.9n/an/an/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [3H]citalopram from SERT in Sprague-dawley rat frontal cortex by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Transporter


(Rattus norvegicus (rat))
BDBM50254072
PNG
((R)-4-(1H-indol-4-yl)-N-methyl-4-(thiophen-2-yl)bu...)
Show SMILES CNCCC[C@@H](c1cccs1)c1cccc2[nH]ccc12 |r|
Show InChI InChI=1S/C17H20N2S/c1-18-10-3-6-15(17-8-4-12-20-17)13-5-2-7-16-14(13)9-11-19-16/h2,4-5,7-9,11-12,15,18-19H,3,6,10H2,1H3/t15-/m1/s1
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79.7n/an/an/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [3H]nisoxetine from Sprague-dawley rat NET by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50254074
PNG
((S)-3-(3,4-dichlorophenyl)-N-methyl-3-(naphthalen-...)
Show SMILES CNCC[C@@H](c1ccc(Cl)c(Cl)c1)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C20H19Cl2N/c1-23-12-11-17(15-9-10-19(21)20(22)13-15)18-8-4-6-14-5-2-3-7-16(14)18/h2-10,13,17,23H,11-12H2,1H3/t17-/m0/s1
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86n/an/an/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [3H]citalopram from SERT in Sprague-dawley rat frontal cortex by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Transporter


(Rattus norvegicus (rat))
BDBM50254027
PNG
((R)-3-(3,4-dichlorophenyl)-3-(1H-indol-4-yl)-N-met...)
Show SMILES CNCC[C@H](c1ccc(Cl)c(Cl)c1)c1cccc2[nH]ccc12 |r|
Show InChI InChI=1S/C18H18Cl2N2/c1-21-9-7-13(12-5-6-16(19)17(20)11-12)14-3-2-4-18-15(14)8-10-22-18/h2-6,8,10-11,13,21-22H,7,9H2,1H3/t13-/m1/s1
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95n/an/an/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [3H]nisoxetine from Sprague-dawley rat NET by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Transporter


(Rattus norvegicus (rat))
BDBM50254050
PNG
((R)-3-(1H-indol-4-yl)-N-methyl-3-(thiophen-2-yl)pr...)
Show SMILES CNCC[C@@H](c1cccs1)c1cccc2[nH]ccc12 |r|
Show InChI InChI=1S/C16H18N2S/c1-17-9-7-14(16-6-3-11-19-16)12-4-2-5-15-13(12)8-10-18-15/h2-6,8,10-11,14,17-18H,7,9H2,1H3/t14-/m1/s1
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102n/an/an/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [3H]nisoxetine from Sprague-dawley rat NET by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Transporter


(Rattus norvegicus (rat))
BDBM50254048
PNG
((R)-N-methyl-4-(naphthalen-1-yl)-4-(thiophen-2-yl)...)
Show SMILES CNCCC[C@@H](c1cccs1)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C19H21NS/c1-20-13-5-11-18(19-12-6-14-21-19)17-10-4-8-15-7-2-3-9-16(15)17/h2-4,6-10,12,14,18,20H,5,11,13H2,1H3/t18-/m1/s1
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109n/an/an/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [3H]nisoxetine from Sprague-dawley rat NET by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Transporter


(Rattus norvegicus (rat))
BDBM50254046
PNG
((R)-N-methyl-3-(naphthalen-1-yl)-3-(thiophen-2-yl)...)
Show SMILES CNCC[C@@H](c1cccs1)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C18H19NS/c1-19-12-11-17(18-10-5-13-20-18)16-9-4-7-14-6-2-3-8-15(14)16/h2-10,13,17,19H,11-12H2,1H3/t17-/m1/s1
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139n/an/an/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [3H]nisoxetine from Sprague-dawley rat NET by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50254050
PNG
((R)-3-(1H-indol-4-yl)-N-methyl-3-(thiophen-2-yl)pr...)
Show SMILES CNCC[C@@H](c1cccs1)c1cccc2[nH]ccc12 |r|
Show InChI InChI=1S/C16H18N2S/c1-17-9-7-14(16-6-3-11-19-16)12-4-2-5-15-13(12)8-10-18-15/h2-6,8,10-11,14,17-18H,7,9H2,1H3/t14-/m1/s1
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166n/an/an/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [3H]citalopram from SERT in Sprague-dawley rat frontal cortex by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50254072
PNG
((R)-4-(1H-indol-4-yl)-N-methyl-4-(thiophen-2-yl)bu...)
Show SMILES CNCCC[C@@H](c1cccs1)c1cccc2[nH]ccc12 |r|
Show InChI InChI=1S/C17H20N2S/c1-18-10-3-6-15(17-8-4-12-20-17)13-5-2-7-16-14(13)9-11-19-16/h2,4-5,7-9,11-12,15,18-19H,3,6,10H2,1H3/t15-/m1/s1
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271n/an/an/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [3H]citalopram from SERT in Sprague-dawley rat frontal cortex by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM22417
PNG
(3-(2-methoxyphenoxy)-N-methyl-3-phenylpropan-1-ami...)
Show SMILES CNCCC(Oc1ccccc1OC)c1ccccc1
Show InChI InChI=1S/C17H21NO2/c1-18-13-12-15(14-8-4-3-5-9-14)20-17-11-7-6-10-16(17)19-2/h3-11,15,18H,12-13H2,1-2H3
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277n/an/an/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [3H]citalopram from SERT in Sprague-dawley rat frontal cortex by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Transporter


(Rattus norvegicus (rat))
BDBM50254112
PNG
((S)-4-(1-(3,4-dimethylphenyl)hexyl)-1H-indene hydr...)
Show SMILES CNCCC[C@@H](c1ccc(Cl)c(Cl)c1)c1cccc2[nH]ccc12 |r|
Show InChI InChI=1S/C19H20Cl2N2/c1-22-10-3-5-14(13-7-8-17(20)18(21)12-13)15-4-2-6-19-16(15)9-11-23-19/h2,4,6-9,11-12,14,22-23H,3,5,10H2,1H3/t14-/m0/s1
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360n/an/an/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [3H]nisoxetine from Sprague-dawley rat NET by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50366567
PNG
(ATOMOXETINE)
Show SMILES CNCC[C@@H](Oc1ccccc1C)c1ccccc1 |r|
Show InChI InChI=1S/C17H21NO/c1-14-8-6-7-11-16(14)19-17(12-13-18-2)15-9-4-3-5-10-15/h3-11,17-18H,12-13H2,1-2H3/t17-/m1/s1
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1.50E+3n/an/an/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [3H]citalopram from SERT in Sprague-dawley rat frontal cortex by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Transporter


(Rattus norvegicus (rat))
BDBM50254074
PNG
((S)-3-(3,4-dichlorophenyl)-N-methyl-3-(naphthalen-...)
Show SMILES CNCC[C@@H](c1ccc(Cl)c(Cl)c1)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C20H19Cl2N/c1-23-12-11-17(15-9-10-19(21)20(22)13-15)18-8-4-6-14-5-2-3-7-16(14)18/h2-10,13,17,23H,11-12H2,1H3/t17-/m0/s1
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1.63E+3n/an/an/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [3H]nisoxetine from Sprague-dawley rat NET by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Transporter


(Rattus norvegicus (rat))
BDBM50254075
PNG
((R)-3-(3,4-dichlorophenyl)-N-methyl-3-(naphthalen-...)
Show SMILES CNCC[C@H](c1ccc(Cl)c(Cl)c1)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C20H19Cl2N/c1-23-12-11-17(15-9-10-19(21)20(22)13-15)18-8-4-6-14-5-2-3-7-16(14)18/h2-10,13,17,23H,11-12H2,1H3/t17-/m1/s1
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1.64E+3n/an/an/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [3H]nisoxetine from Sprague-dawley rat NET by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Transporter


(Rattus norvegicus (rat))
BDBM30130
PNG
(CHEMBL1201082 | CHEMBL41 | Fluoxetin | Fluoxetine ...)
Show SMILES CNCCC(Oc1ccc(cc1)C(F)(F)F)c1ccccc1
Show InChI InChI=1S/C17H18F3NO/c1-21-12-11-16(13-5-3-2-4-6-13)22-15-9-7-14(8-10-15)17(18,19)20/h2-10,16,21H,11-12H2,1H3
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2.00E+3n/an/an/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [3H]nisoxetine from Sprague-dawley rat NET by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Transporter


(Rattus norvegicus (rat))
BDBM50254110
PNG
((R)-4-(3,4-dichlorophenyl)-N-methyl-4-(naphthalen-...)
Show SMILES CNCCC[C@H](c1ccc(Cl)c(Cl)c1)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C21H21Cl2N/c1-24-13-5-10-18(16-11-12-20(22)21(23)14-16)19-9-4-7-15-6-2-3-8-17(15)19/h2-4,6-9,11-12,14,18,24H,5,10,13H2,1H3/t18-/m1/s1
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2.48E+3n/an/an/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [3H]nisoxetine from Sprague-dawley rat NET by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Transporter


(Rattus norvegicus (rat))
BDBM50254113
PNG
((R)-4-(3,4-dichlorophenyl)-4-(1H-indol-4-yl)-N-met...)
Show SMILES CNCCC[C@H](c1ccc(Cl)c(Cl)c1)c1cccc2[nH]ccc12 |r|
Show InChI InChI=1S/C19H20Cl2N2/c1-22-10-3-5-14(13-7-8-17(20)18(21)12-13)15-4-2-6-19-16(15)9-11-23-19/h2,4,6-9,11-12,14,22-23H,3,5,10H2,1H3/t14-/m1/s1
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4.84E+3n/an/an/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [3H]nisoxetine from Sprague-dawley rat NET by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Transporter


(Rattus norvegicus (rat))
BDBM50254076
PNG
((S)-4-(3,4-dichlorophenyl)-N-methyl-4-(naphthalen-...)
Show SMILES CNCCC[C@@H](c1ccc(Cl)c(Cl)c1)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C21H21Cl2N/c1-24-13-5-10-18(16-11-12-20(22)21(23)14-16)19-9-4-7-15-6-2-3-8-17(15)19/h2-4,6-9,11-12,14,18,24H,5,10,13H2,1H3/t18-/m0/s1
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PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [3H]nisoxetine from Sprague-dawley rat NET by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Rattus norvegicus (rat))
BDBM50254113
PNG
((R)-4-(3,4-dichlorophenyl)-4-(1H-indol-4-yl)-N-met...)
Show SMILES CNCCC[C@H](c1ccc(Cl)c(Cl)c1)c1cccc2[nH]ccc12 |r|
Show InChI InChI=1S/C19H20Cl2N2/c1-22-10-3-5-14(13-7-8-17(20)18(21)12-13)15-4-2-6-19-16(15)9-11-23-19/h2,4,6-9,11-12,14,22-23H,3,5,10H2,1H3/t14-/m1/s1
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n/an/a 3.80n/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI55 from DAT in Sprague-dawley rat striatum by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Rattus norvegicus (rat))
BDBM50254027
PNG
((R)-3-(3,4-dichlorophenyl)-3-(1H-indol-4-yl)-N-met...)
Show SMILES CNCC[C@H](c1ccc(Cl)c(Cl)c1)c1cccc2[nH]ccc12 |r|
Show InChI InChI=1S/C18H18Cl2N2/c1-21-9-7-13(12-5-6-16(19)17(20)11-12)14-3-2-4-18-15(14)8-10-22-18/h2-6,8,10-11,13,21-22H,7,9H2,1H3/t13-/m1/s1
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n/an/a 7.21n/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI55 from DAT in Sprague-dawley rat striatum by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Rattus norvegicus (rat))
BDBM50254075
PNG
((R)-3-(3,4-dichlorophenyl)-N-methyl-3-(naphthalen-...)
Show SMILES CNCC[C@H](c1ccc(Cl)c(Cl)c1)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C20H19Cl2N/c1-23-12-11-17(15-9-10-19(21)20(22)13-15)18-8-4-6-14-5-2-3-7-16(14)18/h2-10,13,17,23H,11-12H2,1H3/t17-/m1/s1
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n/an/a 9.70n/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI55 from DAT in Sprague-dawley rat striatum by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Rattus norvegicus (rat))
BDBM50254112
PNG
((S)-4-(1-(3,4-dimethylphenyl)hexyl)-1H-indene hydr...)
Show SMILES CNCCC[C@@H](c1ccc(Cl)c(Cl)c1)c1cccc2[nH]ccc12 |r|
Show InChI InChI=1S/C19H20Cl2N2/c1-22-10-3-5-14(13-7-8-17(20)18(21)12-13)15-4-2-6-19-16(15)9-11-23-19/h2,4,6-9,11-12,14,22-23H,3,5,10H2,1H3/t14-/m0/s1
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n/an/a 14.3n/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI55 from DAT in Sprague-dawley rat striatum by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Rattus norvegicus (rat))
BDBM50254111
PNG
((S)-3-(3,4-dichlorophenyl)-3-(1H-indol-4-yl)-N-met...)
Show SMILES CNCC[C@@H](c1ccc(Cl)c(Cl)c1)c1cccc2[nH]ccc12 |r|
Show InChI InChI=1S/C18H18Cl2N2/c1-21-9-7-13(12-5-6-16(19)17(20)11-12)14-3-2-4-18-15(14)8-10-22-18/h2-6,8,10-11,13,21-22H,7,9H2,1H3/t13-/m0/s1
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n/an/a 14.9n/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI55 from DAT in Sprague-dawley rat striatum by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Rattus norvegicus (rat))
BDBM50254074
PNG
((S)-3-(3,4-dichlorophenyl)-N-methyl-3-(naphthalen-...)
Show SMILES CNCC[C@@H](c1ccc(Cl)c(Cl)c1)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C20H19Cl2N/c1-23-12-11-17(15-9-10-19(21)20(22)13-15)18-8-4-6-14-5-2-3-7-16(14)18/h2-10,13,17,23H,11-12H2,1H3/t17-/m0/s1
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n/an/a 35.8n/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI55 from DAT in Sprague-dawley rat striatum by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Rattus norvegicus (rat))
BDBM50254110
PNG
((R)-4-(3,4-dichlorophenyl)-N-methyl-4-(naphthalen-...)
Show SMILES CNCCC[C@H](c1ccc(Cl)c(Cl)c1)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C21H21Cl2N/c1-24-13-5-10-18(16-11-12-20(22)21(23)14-16)19-9-4-7-15-6-2-3-8-17(15)19/h2-4,6-9,11-12,14,18,24H,5,10,13H2,1H3/t18-/m1/s1
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n/an/a 61.2n/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI55 from DAT in Sprague-dawley rat striatum by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Rattus norvegicus (rat))
BDBM50254076
PNG
((S)-4-(3,4-dichlorophenyl)-N-methyl-4-(naphthalen-...)
Show SMILES CNCCC[C@@H](c1ccc(Cl)c(Cl)c1)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C21H21Cl2N/c1-24-13-5-10-18(16-11-12-20(22)21(23)14-16)19-9-4-7-15-6-2-3-8-17(15)19/h2-4,6-9,11-12,14,18,24H,5,10,13H2,1H3/t18-/m0/s1
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n/an/a 209n/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Displacement of [125I]RTI55 from DAT in Sprague-dawley rat striatum by liquid scintillation spectrophotometry


Bioorg Med Chem Lett 19: 58-61 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.022
BindingDB Entry DOI: 10.7270/Q2N58N95
More data for this
Ligand-Target Pair
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