Compile Data Set for Download or QSAR

Found 21 hits of Enzyme Inhibition Constant Data   

TargetSodium-dependent dopamine transporter(Rattus norvegicus (rat))
Organix Inc.

Curated by ChEMBL
LigandPNGBDBM50066414(Benzhydryl-{2-[1-(4-fluoro-benzyl)-piperidin-4-yl]...)copy SMILEScopy InChI
Affinity DataIC50: 9.40nMAssay Description:IC50 value of the compound was evaluated using [3H]-WIN- 35,428 (radioligand) on Dopamine transporter in rat striatum.More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66JXRPubMed
TargetSodium-dependent dopamine transporter(Rattus norvegicus (rat))
Organix Inc.

Curated by ChEMBL
LigandPNGBDBM50049365(1-Benzyl-4-{2-[bis-(4-fluoro-phenyl)-methoxy]-ethy...)copy SMILEScopy InChI
Affinity DataIC50: 9.70nMAssay Description:IC50 value of the compound was evaluated using [3H]-WIN- 35,428 (radioligand) on Dopamine transporter in rat striatum.More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66JXRPubMed
TargetSodium-dependent dopamine transporter(Rattus norvegicus (rat))
Organix Inc.

Curated by ChEMBL
LigandPNGBDBM50055876(4-(2-Benzhydryloxy-ethyl)-1-(4-fluoro-benzyl)-pipe...)copy SMILEScopy InChI
Affinity DataIC50: 17.2nMAssay Description:IC50 value of the compound was evaluated using [3H]-WIN- 35,428 (radioligand) on Dopamine transporter in rat striatum.More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66JXRPubMed
TargetSodium-dependent dopamine transporter(Rattus norvegicus (rat))
Organix Inc.

Curated by ChEMBL
LigandPNGBDBM22165(1-{2-[bis(4-fluorophenyl)methoxy]ethyl}-4-(3-pheny...)copy SMILEScopy InChI
Affinity DataIC50: 19.3nMAssay Description:IC50 value of the compound was evaluated using [3H]-WIN- 35,428 (radioligand) on Dopamine transporter in rat striatum.More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66JXRPubMed
TargetSodium-dependent dopamine transporter(Homo sapiens (Human))
Organix Inc.

Curated by ChEMBL
LigandPNGBDBM22165(1-{2-[bis(4-fluorophenyl)methoxy]ethyl}-4-(3-pheny...)copy SMILEScopy InChI
Affinity DataIC50: 26nMAssay Description:Affinity of the compound was evaluated using [3H]-DA (radioligand) on Cloned human Dopamine transporter expressed in HEK cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66JXRPubMed
TargetSodium-dependent dopamine transporter(Homo sapiens (Human))
Organix Inc.

Curated by ChEMBL
LigandPNGBDBM50066414(Benzhydryl-{2-[1-(4-fluoro-benzyl)-piperidin-4-yl]...)copy SMILEScopy InChI
Affinity DataIC50: 30nMAssay Description:Affinity of the compound was evaluated using [3H]-WIN- 35,428 (radioligand) on Cloned human Dopamine transporter expressed in HEK cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66JXRPubMed
TargetSodium-dependent dopamine transporter(Homo sapiens (Human))
Organix Inc.

Curated by ChEMBL
LigandPNGBDBM50066414(Benzhydryl-{2-[1-(4-fluoro-benzyl)-piperidin-4-yl]...)copy SMILEScopy InChI
Affinity DataIC50: 32nMAssay Description:Affinity of the compound was evaluated using [3H]-DA (radioligand) on Cloned human Dopamine transporter expressed in HEK cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66JXRPubMed
TargetSodium-dependent dopamine transporter(Homo sapiens (Human))
Organix Inc.

Curated by ChEMBL
LigandPNGBDBM50066416(CHEMBL444592 | [2-(1-Benzyl-piperidin-4-yl)-ethyl]...)copy SMILEScopy InChI
Affinity DataIC50: 33nMAssay Description:Affinity of the compound was evaluated using [3H]-WIN- 35,428 (radioligand) on Cloned human Dopamine transporter expressed in HEK cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66JXRPubMed
TargetSodium-dependent dopamine transporter(Homo sapiens (Human))
Organix Inc.

Curated by ChEMBL
LigandPNGBDBM50049365(1-Benzyl-4-{2-[bis-(4-fluoro-phenyl)-methoxy]-ethy...)copy SMILEScopy InChI
Affinity DataIC50: 35nMAssay Description:Affinity of the compound was evaluated using [3H]-WIN- 35,428 (radioligand) on Cloned human Dopamine transporter expressed in HEK cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66JXRPubMed
TargetSodium-dependent dopamine transporter(Homo sapiens (Human))
Organix Inc.

Curated by ChEMBL
LigandPNGBDBM50055876(4-(2-Benzhydryloxy-ethyl)-1-(4-fluoro-benzyl)-pipe...)copy SMILEScopy InChI
Affinity DataIC50: 37.6nMAssay Description:Affinity of the compound was evaluated using [3H]-WIN- 35,428 (radioligand) on Cloned human Dopamine transporter expressed in HEK cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66JXRPubMed
TargetSodium-dependent dopamine transporter(Homo sapiens (Human))
Organix Inc.

Curated by ChEMBL
LigandPNGBDBM22165(1-{2-[bis(4-fluorophenyl)methoxy]ethyl}-4-(3-pheny...)copy SMILEScopy InChI
Affinity DataIC50: 43nMAssay Description:Affinity of the compound was evaluated using [3H]-WIN- 35,428 (radioligand) on Cloned human Dopamine transporter expressed in HEK cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66JXRPubMed
TargetSodium-dependent dopamine transporter(Homo sapiens (Human))
Organix Inc.

Curated by ChEMBL
LigandPNGBDBM50066416(CHEMBL444592 | [2-(1-Benzyl-piperidin-4-yl)-ethyl]...)copy SMILEScopy InChI
Affinity DataIC50: 58nMAssay Description:Affinity of the compound was evaluated using [3H]-DA (radioligand) on Cloned human Dopamine transporter expressed in HEK cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66JXRPubMed
TargetSodium-dependent serotonin transporter(Rattus norvegicus (rat))
Organix Inc.

Curated by ChEMBL
LigandPNGBDBM22165(1-{2-[bis(4-fluorophenyl)methoxy]ethyl}-4-(3-pheny...)copy SMILEScopy InChI
Affinity DataIC50: 87nMAssay Description:IC50 value of the compound was evaluated using [3H]-citalopram (radioligand) on serotonin transporter in rat striatum.More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66JXRPubMed
TargetSodium-dependent serotonin transporter(Rattus norvegicus (rat))
Organix Inc.

Curated by ChEMBL
LigandPNGBDBM50049365(1-Benzyl-4-{2-[bis-(4-fluoro-phenyl)-methoxy]-ethy...)copy SMILEScopy InChI
Affinity DataIC50: 198nMAssay Description:IC50 value of the compound was evaluated using [3H]-citalopram (radioligand) on serotonin transporter in rat striatum.More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66JXRPubMed
TargetSodium-dependent serotonin transporter(Rattus norvegicus (rat))
Organix Inc.

Curated by ChEMBL
LigandPNGBDBM50066414(Benzhydryl-{2-[1-(4-fluoro-benzyl)-piperidin-4-yl]...)copy SMILEScopy InChI
Affinity DataIC50: 585nMAssay Description:IC50 value of the compound was evaluated using [3H]-citalopram (radioligand) on serotonin transporter in rat striatum.More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66JXRPubMed
TargetSodium-dependent serotonin transporter(Homo sapiens (Human))
Organix Inc.

Curated by ChEMBL
LigandPNGBDBM22165(1-{2-[bis(4-fluorophenyl)methoxy]ethyl}-4-(3-pheny...)copy SMILEScopy InChI
Affinity DataIC50: 741nMAssay Description:Affinity of the compound was evaluated using [3H]-citalopram (radioligand) on human serotonin transporter expressed in HEK cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66JXRPubMed
TargetSodium-dependent serotonin transporter(Rattus norvegicus (rat))
Organix Inc.

Curated by ChEMBL
LigandPNGBDBM50055876(4-(2-Benzhydryloxy-ethyl)-1-(4-fluoro-benzyl)-pipe...)copy SMILEScopy InChI
Affinity DataIC50: 1.92E+3nMAssay Description:IC50 value of the compound was evaluated using [3H]-citalopram (radioligand) on serotonin transporter in rat striatum.More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66JXRPubMed
TargetSodium-dependent dopamine transporter(Homo sapiens (Human))
Organix Inc.

Curated by ChEMBL
LigandPNGBDBM50066415(CHEMBL109776 | N-Benzhydryl-2-[1-(4-fluoro-benzyl)...)copy SMILEScopy InChI
Affinity DataIC50: 3.21E+3nMAssay Description:Affinity of the compound was evaluated using [3H]-WIN- 35,428 (radioligand) on Cloned human Dopamine transporter expressed in HEK cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66JXRPubMed
TargetSodium-dependent serotonin transporter(Homo sapiens (Human))
Organix Inc.

Curated by ChEMBL
LigandPNGBDBM50066414(Benzhydryl-{2-[1-(4-fluoro-benzyl)-piperidin-4-yl]...)copy SMILEScopy InChI
Affinity DataIC50: 5.85E+3nMAssay Description:Affinity of the compound was evaluated using [3H]-citalopram (radioligand) on human serotonin transporter expressed in HEK cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66JXRPubMed
TargetSodium-dependent serotonin transporter(Homo sapiens (Human))
Organix Inc.

Curated by ChEMBL
LigandPNGBDBM50066416(CHEMBL444592 | [2-(1-Benzyl-piperidin-4-yl)-ethyl]...)copy SMILEScopy InChI
Affinity DataIC50: 1.07E+4nMAssay Description:Affinity of the compound was evaluated using [3H]-citalopram (radioligand) on human serotonin transporter expressed in HEK cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66JXRPubMed
TargetSodium-dependent serotonin transporter(Homo sapiens (Human))
Organix Inc.

Curated by ChEMBL
LigandPNGBDBM50066415(CHEMBL109776 | N-Benzhydryl-2-[1-(4-fluoro-benzyl)...)copy SMILEScopy InChI
Affinity DataIC50: 4.92E+4nMAssay Description:Affinity of the compound was evaluated using [3H]-citalopram (radioligand) on human serotonin transporter expressed in HEK cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66JXRPubMed
* indicates data uncertainty>20%