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Compile Data Set for Download or QSAR

Found 38 hits with Last Name = 'ahmad' and Initial = 'uf'   
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 dopamine transporter


(Homo sapiens (human))
BDBM50055003
PNG
(6-(4-Chloro-phenyl)-2,3,4,6-tetrahydro-pyrimido[2,...)
Show SMILES OC1(N2CCCN=C2c2ccccc12)c1ccc(Cl)cc1
Show InChI InChI=1S/C17H15ClN2O/c18-13-8-6-12(7-9-13)17(21)15-5-2-1-4-14(15)16-19-10-3-11-20(16)17/h1-2,4-9,21H,3,10-11H2
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1.70n/an/an/an/an/an/an/an/a



Drew University

Curated by ChEMBL


Assay Description
Inhibition of [125I]- RTI -55 binding at the Dopamine transporter sites on HEK-hDAT cells


J Med Chem 45: 4110-8 (2002)


Article DOI: 10.1021/jm010301z
BindingDB Entry DOI: 10.7270/Q25Q4VF3
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Homo sapiens (human))
BDBM50118294
PNG
(7-(4-Chloro-phenyl)-7,8,9,10-tetrahydro-7a,11-diaz...)
Show SMILES OC1(N2CCCN=C2c2c1ccc1ccccc21)c1ccc(Cl)cc1
Show InChI InChI=1S/C21H17ClN2O/c22-16-9-7-15(8-10-16)21(25)18-11-6-14-4-1-2-5-17(14)19(18)20-23-12-3-13-24(20)21/h1-2,4-11,25H,3,12-13H2
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2.01n/an/an/an/an/an/an/an/a



Drew University

Curated by ChEMBL


Assay Description
Inhibition of [125I]- RTI -55 binding at the Dopamine transporter sites on HEK-hDAT cells


J Med Chem 45: 4110-8 (2002)


Article DOI: 10.1021/jm010301z
BindingDB Entry DOI: 10.7270/Q25Q4VF3
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (human))
BDBM50118291
PNG
(5-Naphthalen-2-yl-2,5-dihydro-3H-imidazo[2,1-a]iso...)
Show SMILES OC1(N2CCN=C2c2ccccc12)c1ccc2ccccc2c1
Show InChI InChI=1S/C20H16N2O/c23-20(16-10-9-14-5-1-2-6-15(14)13-16)18-8-4-3-7-17(18)19-21-11-12-22(19)20/h1-10,13,23H,11-12H2
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2.30n/an/an/an/an/an/an/an/a



Drew University

Curated by ChEMBL


Assay Description
Inhibition of [125I]- RTI -55 binding at the Serotonin transporter sites on HEK-hSERT cells


J Med Chem 45: 4110-8 (2002)


Article DOI: 10.1021/jm010301z
BindingDB Entry DOI: 10.7270/Q25Q4VF3
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Homo sapiens (human))
BDBM50118289
PNG
(7-Naphthalen-2-yl-8,9-dihydro-7H-7a,10-diaza-penta...)
Show SMILES OC1(N2CCN=C2c2c1ccc1ccccc21)c1ccc2ccccc2c1
Show InChI InChI=1S/C24H18N2O/c27-24(19-11-9-16-5-1-2-7-18(16)15-19)21-12-10-17-6-3-4-8-20(17)22(21)23-25-13-14-26(23)24/h1-12,15,27H,13-14H2
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2.83n/an/an/an/an/an/an/an/a



Drew University

Curated by ChEMBL


Assay Description
Inhibition of [125I]- RTI -55 binding at the Dopamine transporter sites on HEK-hDAT cells


J Med Chem 45: 4110-8 (2002)


Article DOI: 10.1021/jm010301z
BindingDB Entry DOI: 10.7270/Q25Q4VF3
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (human))
BDBM50118289
PNG
(7-Naphthalen-2-yl-8,9-dihydro-7H-7a,10-diaza-penta...)
Show SMILES OC1(N2CCN=C2c2c1ccc1ccccc21)c1ccc2ccccc2c1
Show InChI InChI=1S/C24H18N2O/c27-24(19-11-9-16-5-1-2-7-18(16)15-19)21-12-10-17-6-3-4-8-20(17)22(21)23-25-13-14-26(23)24/h1-12,15,27H,13-14H2
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5.20n/an/an/an/an/an/an/an/a



Drew University

Curated by ChEMBL


Assay Description
Inhibition of [125I]- RTI -55 binding at the Norepinephrin transpoter sites on HEK-hNET cells


J Med Chem 45: 4110-8 (2002)


Article DOI: 10.1021/jm010301z
BindingDB Entry DOI: 10.7270/Q25Q4VF3
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (human))
BDBM50118294
PNG
(7-(4-Chloro-phenyl)-7,8,9,10-tetrahydro-7a,11-diaz...)
Show SMILES OC1(N2CCCN=C2c2c1ccc1ccccc21)c1ccc(Cl)cc1
Show InChI InChI=1S/C21H17ClN2O/c22-16-9-7-15(8-10-16)21(25)18-11-6-14-4-1-2-5-17(14)19(18)20-23-12-3-13-24(20)21/h1-2,4-11,25H,3,12-13H2
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5.30n/an/an/an/an/an/an/an/a



Drew University

Curated by ChEMBL


Assay Description
Inhibition of [125I]- RTI -55 binding at the Norepinephrin transpoter sites on HEK-hNET cells


J Med Chem 45: 4110-8 (2002)


Article DOI: 10.1021/jm010301z
BindingDB Entry DOI: 10.7270/Q25Q4VF3
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (human))
BDBM50118294
PNG
(7-(4-Chloro-phenyl)-7,8,9,10-tetrahydro-7a,11-diaz...)
Show SMILES OC1(N2CCCN=C2c2c1ccc1ccccc21)c1ccc(Cl)cc1
Show InChI InChI=1S/C21H17ClN2O/c22-16-9-7-15(8-10-16)21(25)18-11-6-14-4-1-2-5-17(14)19(18)20-23-12-3-13-24(20)21/h1-2,4-11,25H,3,12-13H2
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5.5n/an/an/an/an/an/an/an/a



Drew University

Curated by ChEMBL


Assay Description
Inhibition of [125I]- RTI -55 binding at the Serotonin transporter sites on HEK-hSERT cells


J Med Chem 45: 4110-8 (2002)


Article DOI: 10.1021/jm010301z
BindingDB Entry DOI: 10.7270/Q25Q4VF3
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (human))
BDBM50118289
PNG
(7-Naphthalen-2-yl-8,9-dihydro-7H-7a,10-diaza-penta...)
Show SMILES OC1(N2CCN=C2c2c1ccc1ccccc21)c1ccc2ccccc2c1
Show InChI InChI=1S/C24H18N2O/c27-24(19-11-9-16-5-1-2-7-18(16)15-19)21-12-10-17-6-3-4-8-20(17)22(21)23-25-13-14-26(23)24/h1-12,15,27H,13-14H2
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11n/an/an/an/an/an/an/an/a



Drew University

Curated by ChEMBL


Assay Description
Inhibition of [125I]- RTI -55 binding at the Serotonin transporter sites on HEK-hSERT cells


J Med Chem 45: 4110-8 (2002)


Article DOI: 10.1021/jm010301z
BindingDB Entry DOI: 10.7270/Q25Q4VF3
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (human))
BDBM50118291
PNG
(5-Naphthalen-2-yl-2,5-dihydro-3H-imidazo[2,1-a]iso...)
Show SMILES OC1(N2CCN=C2c2ccccc12)c1ccc2ccccc2c1
Show InChI InChI=1S/C20H16N2O/c23-20(16-10-9-14-5-1-2-6-15(14)13-16)18-8-4-3-7-17(18)19-21-11-12-22(19)20/h1-10,13,23H,11-12H2
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11n/an/an/an/an/an/an/an/a



Drew University

Curated by ChEMBL


Assay Description
Inhibition of [125I]- RTI -55 binding at the Norepinephrin transpoter sites on HEK-hNET cells


J Med Chem 45: 4110-8 (2002)


Article DOI: 10.1021/jm010301z
BindingDB Entry DOI: 10.7270/Q25Q4VF3
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (human))
BDBM50005536
PNG
(42-548 | 5-(4-Chloro-phenyl)-2,5-dihydro-3H-imidaz...)
Show SMILES OC1(N2CCN=C2c2ccccc12)c1ccc(Cl)cc1
Show InChI InChI=1S/C16H13ClN2O/c17-12-7-5-11(6-8-12)16(20)14-4-2-1-3-13(14)15-18-9-10-19(15)16/h1-8,20H,9-10H2
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18n/an/an/an/an/an/an/an/a



Drew University

Curated by ChEMBL


Assay Description
Inhibition of [125I]- RTI -55 binding at the Norepinephrin transpoter sites on HEK-hNET cells


J Med Chem 45: 4110-8 (2002)


Article DOI: 10.1021/jm010301z
BindingDB Entry DOI: 10.7270/Q25Q4VF3
More data for this
Ligand-Target Pair
Dopamine Transporter (DAT)


(Rattus norvegicus (rat))
BDBM50055003
PNG
(6-(4-Chloro-phenyl)-2,3,4,6-tetrahydro-pyrimido[2,...)
Show SMILES OC1(N2CCCN=C2c2ccccc12)c1ccc(Cl)cc1
Show InChI InChI=1S/C17H15ClN2O/c18-13-8-6-12(7-9-13)17(21)15-5-2-1-4-14(15)16-19-10-3-11-20(16)17/h1-2,4-9,21H,3,10-11H2
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18n/an/an/an/an/an/an/an/a



Drew University

Curated by ChEMBL


Assay Description
Ability to displace [3H]- WIN 35,428 from dopamine transporter on rat striatal membrane.


J Med Chem 45: 4110-8 (2002)


Article DOI: 10.1021/jm010301z
BindingDB Entry DOI: 10.7270/Q25Q4VF3
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Homo sapiens (human))
BDBM50118293
PNG
(7-(4-Chloro-phenyl)-8,9-dihydro-7H-7a,10-diaza-pen...)
Show SMILES OC1(N2CCN=C2c2c1ccc1ccccc21)c1ccc(Cl)cc1
Show InChI InChI=1S/C20H15ClN2O/c21-15-8-6-14(7-9-15)20(24)17-10-5-13-3-1-2-4-16(13)18(17)19-22-11-12-23(19)20/h1-10,24H,11-12H2
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27.2n/an/an/an/an/an/an/an/a



Drew University

Curated by ChEMBL


Assay Description
Inhibition of [125I]- RTI -55 binding at the Dopamine transporter sites on HEK-hDAT cells


J Med Chem 45: 4110-8 (2002)


Article DOI: 10.1021/jm010301z
BindingDB Entry DOI: 10.7270/Q25Q4VF3
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (human))
BDBM50118293
PNG
(7-(4-Chloro-phenyl)-8,9-dihydro-7H-7a,10-diaza-pen...)
Show SMILES OC1(N2CCN=C2c2c1ccc1ccccc21)c1ccc(Cl)cc1
Show InChI InChI=1S/C20H15ClN2O/c21-15-8-6-14(7-9-15)20(24)17-10-5-13-3-1-2-4-16(13)18(17)19-22-11-12-23(19)20/h1-10,24H,11-12H2
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33.4n/an/an/an/an/an/an/an/a



Drew University

Curated by ChEMBL


Assay Description
Inhibition of [125I]- RTI -55 binding at the Norepinephrin transpoter sites on HEK-hNET cells


J Med Chem 45: 4110-8 (2002)


Article DOI: 10.1021/jm010301z
BindingDB Entry DOI: 10.7270/Q25Q4VF3
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (human))
BDBM50055003
PNG
(6-(4-Chloro-phenyl)-2,3,4,6-tetrahydro-pyrimido[2,...)
Show SMILES OC1(N2CCCN=C2c2ccccc12)c1ccc(Cl)cc1
Show InChI InChI=1S/C17H15ClN2O/c18-13-8-6-12(7-9-13)17(21)15-5-2-1-4-14(15)16-19-10-3-11-20(16)17/h1-2,4-9,21H,3,10-11H2
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39n/an/an/an/an/an/an/an/a



Drew University

Curated by ChEMBL


Assay Description
Inhibition of [125I]- RTI -55 binding at the Serotonin transporter sites on HEK-hSERT cells


J Med Chem 45: 4110-8 (2002)


Article DOI: 10.1021/jm010301z
BindingDB Entry DOI: 10.7270/Q25Q4VF3
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Homo sapiens (human))
BDBM50118291
PNG
(5-Naphthalen-2-yl-2,5-dihydro-3H-imidazo[2,1-a]iso...)
Show SMILES OC1(N2CCN=C2c2ccccc12)c1ccc2ccccc2c1
Show InChI InChI=1S/C20H16N2O/c23-20(16-10-9-14-5-1-2-6-15(14)13-16)18-8-4-3-7-17(18)19-21-11-12-22(19)20/h1-10,13,23H,11-12H2
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45n/an/an/an/an/an/an/an/a



Drew University

Curated by ChEMBL


Assay Description
Inhibition of [125I]- RTI -55 binding at the Dopamine transporter sites on HEK-hDAT cells


J Med Chem 45: 4110-8 (2002)


Article DOI: 10.1021/jm010301z
BindingDB Entry DOI: 10.7270/Q25Q4VF3
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Homo sapiens (human))
BDBM50005536
PNG
(42-548 | 5-(4-Chloro-phenyl)-2,5-dihydro-3H-imidaz...)
Show SMILES OC1(N2CCN=C2c2ccccc12)c1ccc(Cl)cc1
Show InChI InChI=1S/C16H13ClN2O/c17-12-7-5-11(6-8-12)16(20)14-4-2-1-3-13(14)15-18-9-10-19(15)16/h1-8,20H,9-10H2
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45n/an/an/an/an/an/an/an/a



Drew University

Curated by ChEMBL


Assay Description
Inhibition of [125I]- RTI -55 binding at the Dopamine transporter sites on HEK-hDAT cells


J Med Chem 45: 4110-8 (2002)


Article DOI: 10.1021/jm010301z
BindingDB Entry DOI: 10.7270/Q25Q4VF3
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (human))
BDBM50005536
PNG
(42-548 | 5-(4-Chloro-phenyl)-2,5-dihydro-3H-imidaz...)
Show SMILES OC1(N2CCN=C2c2ccccc12)c1ccc(Cl)cc1
Show InChI InChI=1S/C16H13ClN2O/c17-12-7-5-11(6-8-12)16(20)14-4-2-1-3-13(14)15-18-9-10-19(15)16/h1-8,20H,9-10H2
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50n/an/an/an/an/an/an/an/a



Drew University

Curated by ChEMBL


Assay Description
Inhibition of [125I]- RTI -55 binding at the Serotonin transporter sites on HEK-hSERT cells


J Med Chem 45: 4110-8 (2002)


Article DOI: 10.1021/jm010301z
BindingDB Entry DOI: 10.7270/Q25Q4VF3
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Homo sapiens (human))
BDBM50118295
PNG
(11-(4-Chloro-phenyl)-5a,7,8,9,9a,11-hexahydro-6H-b...)
Show SMILES OC1(N2[C@H]3CCCC[C@@H]3N=C2c2ccccc12)c1ccc(Cl)cc1
Show InChI InChI=1S/C20H19ClN2O/c21-14-11-9-13(10-12-14)20(24)16-6-2-1-5-15(16)19-22-17-7-3-4-8-18(17)23(19)20/h1-2,5-6,9-12,17-18,24H,3-4,7-8H2/t17-,18-,20?/m0/s1
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152n/an/an/an/an/an/an/an/a



Drew University

Curated by ChEMBL


Assay Description
Inhibition of [125I]- RTI -55 binding at the Dopamine transporter sites on HEK-hDAT cells


J Med Chem 45: 4110-8 (2002)


Article DOI: 10.1021/jm010301z
BindingDB Entry DOI: 10.7270/Q25Q4VF3
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (human))
BDBM50118293
PNG
(7-(4-Chloro-phenyl)-8,9-dihydro-7H-7a,10-diaza-pen...)
Show SMILES OC1(N2CCN=C2c2c1ccc1ccccc21)c1ccc(Cl)cc1
Show InChI InChI=1S/C20H15ClN2O/c21-15-8-6-14(7-9-15)20(24)17-10-5-13-3-1-2-4-16(13)18(17)19-22-11-12-23(19)20/h1-10,24H,11-12H2
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224n/an/an/an/an/an/an/an/a



Drew University

Curated by ChEMBL


Assay Description
Inhibition of [125I]- RTI -55 binding at the Serotonin transporter sites on HEK-hSERT cells


J Med Chem 45: 4110-8 (2002)


Article DOI: 10.1021/jm010301z
BindingDB Entry DOI: 10.7270/Q25Q4VF3
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (human))
BDBM50118295
PNG
(11-(4-Chloro-phenyl)-5a,7,8,9,9a,11-hexahydro-6H-b...)
Show SMILES OC1(N2[C@H]3CCCC[C@@H]3N=C2c2ccccc12)c1ccc(Cl)cc1
Show InChI InChI=1S/C20H19ClN2O/c21-14-11-9-13(10-12-14)20(24)16-6-2-1-5-15(16)19-22-17-7-3-4-8-18(17)23(19)20/h1-2,5-6,9-12,17-18,24H,3-4,7-8H2/t17-,18-,20?/m0/s1
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600n/an/an/an/an/an/an/an/a



Drew University

Curated by ChEMBL


Assay Description
Inhibition of [125I]- RTI -55 binding at the Serotonin transporter sites on HEK-hSERT cells


J Med Chem 45: 4110-8 (2002)


Article DOI: 10.1021/jm010301z
BindingDB Entry DOI: 10.7270/Q25Q4VF3
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (human))
BDBM50118295
PNG
(11-(4-Chloro-phenyl)-5a,7,8,9,9a,11-hexahydro-6H-b...)
Show SMILES OC1(N2[C@H]3CCCC[C@@H]3N=C2c2ccccc12)c1ccc(Cl)cc1
Show InChI InChI=1S/C20H19ClN2O/c21-14-11-9-13(10-12-14)20(24)16-6-2-1-5-15(16)19-22-17-7-3-4-8-18(17)23(19)20/h1-2,5-6,9-12,17-18,24H,3-4,7-8H2/t17-,18-,20?/m0/s1
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690n/an/an/an/an/an/an/an/a



Drew University

Curated by ChEMBL


Assay Description
Inhibition of [125I]- RTI -55 binding at the Norepinephrin transpoter sites on HEK-hNET cells


J Med Chem 45: 4110-8 (2002)


Article DOI: 10.1021/jm010301z
BindingDB Entry DOI: 10.7270/Q25Q4VF3
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Homo sapiens (human))
BDBM50118294
PNG
(7-(4-Chloro-phenyl)-7,8,9,10-tetrahydro-7a,11-diaz...)
Show SMILES OC1(N2CCCN=C2c2c1ccc1ccccc21)c1ccc(Cl)cc1
Show InChI InChI=1S/C21H17ClN2O/c22-16-9-7-15(8-10-16)21(25)18-11-6-14-4-1-2-5-17(14)19(18)20-23-12-3-13-24(20)21/h1-2,4-11,25H,3,12-13H2
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n/an/a 2.10n/an/an/an/an/an/a



Drew University

Curated by ChEMBL


Assay Description
Ability to displace [3H]- WIN 35,428 from dopamine transporter on guinea pig striatal membrane.


J Med Chem 45: 4110-8 (2002)


Article DOI: 10.1021/jm010301z
BindingDB Entry DOI: 10.7270/Q25Q4VF3
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Homo sapiens (human))
BDBM50118295
PNG
(11-(4-Chloro-phenyl)-5a,7,8,9,9a,11-hexahydro-6H-b...)
Show SMILES OC1(N2[C@H]3CCCC[C@@H]3N=C2c2ccccc12)c1ccc(Cl)cc1
Show InChI InChI=1S/C20H19ClN2O/c21-14-11-9-13(10-12-14)20(24)16-6-2-1-5-15(16)19-22-17-7-3-4-8-18(17)23(19)20/h1-2,5-6,9-12,17-18,24H,3-4,7-8H2/t17-,18-,20?/m0/s1
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n/an/a 2.70n/an/an/an/an/an/a



Drew University

Curated by ChEMBL


Assay Description
Ability to displace [3H]- WIN 35,428 from dopamine transporter on guinea pig striatal membrane.


J Med Chem 45: 4110-8 (2002)


Article DOI: 10.1021/jm010301z
BindingDB Entry DOI: 10.7270/Q25Q4VF3
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Homo sapiens (human))
BDBM50118289
PNG
(7-Naphthalen-2-yl-8,9-dihydro-7H-7a,10-diaza-penta...)
Show SMILES OC1(N2CCN=C2c2c1ccc1ccccc21)c1ccc2ccccc2c1
Show InChI InChI=1S/C24H18N2O/c27-24(19-11-9-16-5-1-2-7-18(16)15-19)21-12-10-17-6-3-4-8-20(17)22(21)23-25-13-14-26(23)24/h1-12,15,27H,13-14H2
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n/an/a 3.30n/an/an/an/an/an/a



Drew University

Curated by ChEMBL


Assay Description
Ability to displace [3H]- WIN 35,428 from dopamine transporter on guinea pig striatal membrane.


J Med Chem 45: 4110-8 (2002)


Article DOI: 10.1021/jm010301z
BindingDB Entry DOI: 10.7270/Q25Q4VF3
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Homo sapiens (human))
BDBM50118291
PNG
(5-Naphthalen-2-yl-2,5-dihydro-3H-imidazo[2,1-a]iso...)
Show SMILES OC1(N2CCN=C2c2ccccc12)c1ccc2ccccc2c1
Show InChI InChI=1S/C20H16N2O/c23-20(16-10-9-14-5-1-2-6-15(14)13-16)18-8-4-3-7-17(18)19-21-11-12-22(19)20/h1-10,13,23H,11-12H2
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n/an/a 4.10n/an/an/an/an/an/a



Drew University

Curated by ChEMBL


Assay Description
Ability to displace [3H]- WIN 35,428 from dopamine transporter on guinea pig striatal membrane.


J Med Chem 45: 4110-8 (2002)


Article DOI: 10.1021/jm010301z
BindingDB Entry DOI: 10.7270/Q25Q4VF3
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Homo sapiens (human))
BDBM50055003
PNG
(6-(4-Chloro-phenyl)-2,3,4,6-tetrahydro-pyrimido[2,...)
Show SMILES OC1(N2CCCN=C2c2ccccc12)c1ccc(Cl)cc1
Show InChI InChI=1S/C17H15ClN2O/c18-13-8-6-12(7-9-13)17(21)15-5-2-1-4-14(15)16-19-10-3-11-20(16)17/h1-2,4-9,21H,3,10-11H2
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n/an/a 4.20n/an/an/an/an/an/a



Drew University

Curated by ChEMBL


Assay Description
Ability to displace [3H]- WIN 35,428 from dopamine transporter on guinea pig striatal membrane.


J Med Chem 45: 4110-8 (2002)


Article DOI: 10.1021/jm010301z
BindingDB Entry DOI: 10.7270/Q25Q4VF3
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Homo sapiens (human))
BDBM50118297
PNG
(11-(4-Chloro-phenyl)-5a,7,8,9,9a,11-hexahydro-6H-b...)
Show SMILES OC1(N2[C@H]3CCCC[C@H]3N=C2c2ccccc12)c1ccc(Cl)cc1
Show InChI InChI=1S/C20H19ClN2O/c21-14-11-9-13(10-12-14)20(24)16-6-2-1-5-15(16)19-22-17-7-3-4-8-18(17)23(19)20/h1-2,5-6,9-12,17-18,24H,3-4,7-8H2/t17-,18+,20?/m1/s1
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n/an/a 8.40n/an/an/an/an/an/a



Drew University

Curated by ChEMBL


Assay Description
Ability to displace [3H]- WIN 35,428 from dopamine transporter on guinea pig striatal membrane.


J Med Chem 45: 4110-8 (2002)


Article DOI: 10.1021/jm010301z
BindingDB Entry DOI: 10.7270/Q25Q4VF3
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Homo sapiens (human))
BDBM50118293
PNG
(7-(4-Chloro-phenyl)-8,9-dihydro-7H-7a,10-diaza-pen...)
Show SMILES OC1(N2CCN=C2c2c1ccc1ccccc21)c1ccc(Cl)cc1
Show InChI InChI=1S/C20H15ClN2O/c21-15-8-6-14(7-9-15)20(24)17-10-5-13-3-1-2-4-16(13)18(17)19-22-11-12-23(19)20/h1-10,24H,11-12H2
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n/an/a 10.6n/an/an/an/an/an/a



Drew University

Curated by ChEMBL


Assay Description
Ability to displace [3H]- WIN 35,428 from dopamine transporter on guinea pig striatal membrane.


J Med Chem 45: 4110-8 (2002)


Article DOI: 10.1021/jm010301z
BindingDB Entry DOI: 10.7270/Q25Q4VF3
More data for this
Ligand-Target Pair
Dopamine Transporter (DAT)


(Rattus norvegicus (rat))
BDBM50005536
PNG
(42-548 | 5-(4-Chloro-phenyl)-2,5-dihydro-3H-imidaz...)
Show SMILES OC1(N2CCN=C2c2ccccc12)c1ccc(Cl)cc1
Show InChI InChI=1S/C16H13ClN2O/c17-12-7-5-11(6-8-12)16(20)14-4-2-1-3-13(14)15-18-9-10-19(15)16/h1-8,20H,9-10H2
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n/an/a 12.9n/an/an/an/an/an/a



Drew University

Curated by ChEMBL


Assay Description
Ability to displace [3H]- WIN 35,428 from dopamine transporter on rat striatal membrane.


J Med Chem 45: 4110-8 (2002)


Article DOI: 10.1021/jm010301z
BindingDB Entry DOI: 10.7270/Q25Q4VF3
More data for this
Ligand-Target Pair
Dopamine Transporter (DAT)


(Rattus norvegicus (rat))
BDBM50118293
PNG
(7-(4-Chloro-phenyl)-8,9-dihydro-7H-7a,10-diaza-pen...)
Show SMILES OC1(N2CCN=C2c2c1ccc1ccccc21)c1ccc(Cl)cc1
Show InChI InChI=1S/C20H15ClN2O/c21-15-8-6-14(7-9-15)20(24)17-10-5-13-3-1-2-4-16(13)18(17)19-22-11-12-23(19)20/h1-10,24H,11-12H2
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n/an/a 16.0n/an/an/an/an/an/a



Drew University

Curated by ChEMBL


Assay Description
Ability to displace [3H]- WIN 35,428 from dopamine transporter on rat striatal membrane.


J Med Chem 45: 4110-8 (2002)


Article DOI: 10.1021/jm010301z
BindingDB Entry DOI: 10.7270/Q25Q4VF3
More data for this
Ligand-Target Pair
Dopamine Transporter (DAT)


(Rattus norvegicus (rat))
BDBM50118291
PNG
(5-Naphthalen-2-yl-2,5-dihydro-3H-imidazo[2,1-a]iso...)
Show SMILES OC1(N2CCN=C2c2ccccc12)c1ccc2ccccc2c1
Show InChI InChI=1S/C20H16N2O/c23-20(16-10-9-14-5-1-2-6-15(14)13-16)18-8-4-3-7-17(18)19-21-11-12-22(19)20/h1-10,13,23H,11-12H2
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n/an/a 23.3n/an/an/an/an/an/a



Drew University

Curated by ChEMBL


Assay Description
Ability to displace [3H]- WIN 35,428 from dopamine transporter on rat striatal membrane.


J Med Chem 45: 4110-8 (2002)


Article DOI: 10.1021/jm010301z
BindingDB Entry DOI: 10.7270/Q25Q4VF3
More data for this
Ligand-Target Pair
Dopamine Transporter (DAT)


(Rattus norvegicus (rat))
BDBM50118295
PNG
(11-(4-Chloro-phenyl)-5a,7,8,9,9a,11-hexahydro-6H-b...)
Show SMILES OC1(N2[C@H]3CCCC[C@@H]3N=C2c2ccccc12)c1ccc(Cl)cc1
Show InChI InChI=1S/C20H19ClN2O/c21-14-11-9-13(10-12-14)20(24)16-6-2-1-5-15(16)19-22-17-7-3-4-8-18(17)23(19)20/h1-2,5-6,9-12,17-18,24H,3-4,7-8H2/t17-,18-,20?/m0/s1
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n/an/a 34.2n/an/an/an/an/an/a



Drew University

Curated by ChEMBL


Assay Description
Ability to displace [3H]- WIN 35,428 from dopamine transporter on rat striatal membrane.


J Med Chem 45: 4110-8 (2002)


Article DOI: 10.1021/jm010301z
BindingDB Entry DOI: 10.7270/Q25Q4VF3
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Homo sapiens (human))
BDBM50118292
PNG
(10-(4-Chloro-phenyl)-2,10-dihydro-1H-3,10a-diaza-p...)
Show SMILES OC1(N2CCN=C2c2cc3ccccc3cc12)c1ccc(Cl)cc1
Show InChI InChI=1S/C20H15ClN2O/c21-16-7-5-15(6-8-16)20(24)18-12-14-4-2-1-3-13(14)11-17(18)19-22-9-10-23(19)20/h1-8,11-12,24H,9-10H2
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n/an/a 36.1n/an/an/an/an/an/a



Drew University

Curated by ChEMBL


Assay Description
Ability to displace [3H]- WIN 35,428 from dopamine transporter on guinea pig striatal membrane.


J Med Chem 45: 4110-8 (2002)


Article DOI: 10.1021/jm010301z
BindingDB Entry DOI: 10.7270/Q25Q4VF3
More data for this
Ligand-Target Pair
Dopamine Transporter (DAT)


(Rattus norvegicus (rat))
BDBM50118294
PNG
(7-(4-Chloro-phenyl)-7,8,9,10-tetrahydro-7a,11-diaz...)
Show SMILES OC1(N2CCCN=C2c2c1ccc1ccccc21)c1ccc(Cl)cc1
Show InChI InChI=1S/C21H17ClN2O/c22-16-9-7-15(8-10-16)21(25)18-11-6-14-4-1-2-5-17(14)19(18)20-23-12-3-13-24(20)21/h1-2,4-11,25H,3,12-13H2
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n/an/a 37.3n/an/an/an/an/an/a



Drew University

Curated by ChEMBL


Assay Description
Ability to displace [3H]- WIN 35,428 from dopamine transporter on rat striatal membrane.


J Med Chem 45: 4110-8 (2002)


Article DOI: 10.1021/jm010301z
BindingDB Entry DOI: 10.7270/Q25Q4VF3
More data for this
Ligand-Target Pair
Dopamine Transporter (DAT)


(Rattus norvegicus (rat))
BDBM50118289
PNG
(7-Naphthalen-2-yl-8,9-dihydro-7H-7a,10-diaza-penta...)
Show SMILES OC1(N2CCN=C2c2c1ccc1ccccc21)c1ccc2ccccc2c1
Show InChI InChI=1S/C24H18N2O/c27-24(19-11-9-16-5-1-2-7-18(16)15-19)21-12-10-17-6-3-4-8-20(17)22(21)23-25-13-14-26(23)24/h1-12,15,27H,13-14H2
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n/an/a 38.1n/an/an/an/an/an/a



Drew University

Curated by ChEMBL


Assay Description
Ability to displace [3H]- WIN 35,428 from dopamine transporter on rat striatal membrane.


J Med Chem 45: 4110-8 (2002)


Article DOI: 10.1021/jm010301z
BindingDB Entry DOI: 10.7270/Q25Q4VF3
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Homo sapiens (human))
BDBM50005536
PNG
(42-548 | 5-(4-Chloro-phenyl)-2,5-dihydro-3H-imidaz...)
Show SMILES OC1(N2CCN=C2c2ccccc12)c1ccc(Cl)cc1
Show InChI InChI=1S/C16H13ClN2O/c17-12-7-5-11(6-8-12)16(20)14-4-2-1-3-13(14)15-18-9-10-19(15)16/h1-8,20H,9-10H2
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n/an/a 42.6n/an/an/an/an/an/a



Drew University

Curated by ChEMBL


Assay Description
Ability to displace [3H]- WIN 35,428 from dopamine transporter on guinea pig striatal membrane.


J Med Chem 45: 4110-8 (2002)


Article DOI: 10.1021/jm010301z
BindingDB Entry DOI: 10.7270/Q25Q4VF3
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Homo sapiens (human))
BDBM50118290
PNG
(10-(4-Chloro-phenyl)-8,10-dihydro-9H-7,9a-diaza-pe...)
Show SMILES OC1(N2CCN=C2c2ccc3ccccc3c12)c1ccc(Cl)cc1
Show InChI InChI=1S/C20H15ClN2O/c21-15-8-6-14(7-9-15)20(24)18-16-4-2-1-3-13(16)5-10-17(18)19-22-11-12-23(19)20/h1-10,24H,11-12H2
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n/an/a 218n/an/an/an/an/an/a



Drew University

Curated by ChEMBL


Assay Description
Ability to displace [3H]- WIN 35,428 from dopamine transporter on guinea pig striatal membrane.


J Med Chem 45: 4110-8 (2002)


Article DOI: 10.1021/jm010301z
BindingDB Entry DOI: 10.7270/Q25Q4VF3
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Homo sapiens (human))
BDBM50118296
PNG
(5-Naphthalen-1-yl-2,5-dihydro-3H-imidazo[2,1-a]iso...)
Show SMILES OC1(N2CCN=C2c2ccccc12)c1cccc2ccccc12
Show InChI InChI=1S/C20H16N2O/c23-20(17-11-5-7-14-6-1-2-8-15(14)17)18-10-4-3-9-16(18)19-21-12-13-22(19)20/h1-11,23H,12-13H2
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n/an/a 1.84E+3n/an/an/an/an/an/a



Drew University

Curated by ChEMBL


Assay Description
Ability to displace [3H]- WIN 35,428 from dopamine transporter on guinea pig striatal membrane.


J Med Chem 45: 4110-8 (2002)


Article DOI: 10.1021/jm010301z
BindingDB Entry DOI: 10.7270/Q25Q4VF3
More data for this
Ligand-Target Pair