BDBM50062915 CHEMBL827::METHYLPHENIDATE::methyl (2R)-phenyl[(2R)-piperidin-2-yl]acetate::methyl (R)-phenyl[(R)-piperidin-2-yl]acetate

SMILES COC(=O)[C@@H]([C@H]1CCCCN1)c1ccccc1

InChI Key InChIKey=DUGOZIWVEXMGBE-UHFFFAOYSA-N

Data  5 KI  10 IC50

PDB links: 1 PDB ID matches this monomer.

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 15 hits for monomerid = 50062915   

TargetSodium-dependent dopamine transporter(Human)
Organix

Curated by ChEMBL
LigandPNGBDBM50062915(methyl (2R)-phenyl[(2R)-piperidin-2-yl]acetate | m...)
Affinity DataIC50: 88nMAssay Description:Inhibition of [3H]WIN-35428 Binding to the Dopamine Transporter in Rhesus (Macaca mulatta) orCynomolgus Monkey (Macaca fascicularis) Caudate-PutamenMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetSodium-dependent dopamine transporter(Rat)
Institute of Technology

Curated by ChEMBL
LigandPNGBDBM50062915(methyl (2R)-phenyl[(2R)-piperidin-2-yl]acetate | m...)
Affinity DataIC50: 83nMAssay Description:Displacement of [3H]WIN 35428 from Sprague-Dawley rat striatal tissue after 2 hrs by liquid scintillation countingMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/12/2011
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetSodium-dependent dopamine transporter(Human)
Organix

Curated by ChEMBL
LigandPNGBDBM50062915(methyl (2R)-phenyl[(2R)-piperidin-2-yl]acetate | m...)
Affinity DataIC50: 156nMAssay Description:Inhibition of [3H]dopamine uptake at human DAT expressed in mouse N2A cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/22/2011
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetSodium-dependent dopamine transporter(Rat)
Institute of Technology

Curated by ChEMBL
LigandPNGBDBM50062915(methyl (2R)-phenyl[(2R)-piperidin-2-yl]acetate | m...)
Affinity DataIC50: 83nMAssay Description:The compound was tested for its affinity at the rat striatal dopamine transporter by the displacement of [3H]WIN-35428More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/28/2012
Entry Details Article
PDB3D3D Structure (crystal)
TargetSodium-dependent serotonin transporter(Rat)
Georgia Institute of Technology

Curated by ChEMBL
LigandPNGBDBM50062915(methyl (2R)-phenyl[(2R)-piperidin-2-yl]acetate | m...)
Affinity DataIC50: 2.24E+5nMAssay Description:Selectivity for the Serotonin transporter using [3H]paroxetine binding assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/13/2012
Entry Details Article
PubMed
TargetSodium-dependent dopamine transporter(Rat)
Institute of Technology

Curated by ChEMBL
LigandPNGBDBM50062915(methyl (2R)-phenyl[(2R)-piperidin-2-yl]acetate | m...)
Affinity DataIC50: 24nMAssay Description:Inhibitory potency against [3H]DA uptake using [3H]WIN-35428 (WIN-) binding assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/13/2012
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetSodium-dependent dopamine transporter(Rat)
Institute of Technology

Curated by ChEMBL
LigandPNGBDBM50062915(methyl (2R)-phenyl[(2R)-piperidin-2-yl]acetate | m...)
Affinity DataIC50: 83nMAssay Description:Inhibitory potency against dopamine (DA) transporter using [3H]WIN-35428 (WIN-) binding assay.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/13/2012
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetTransporter(Rat)
Georgia Institute of Technology

Curated by ChEMBL
LigandPNGBDBM50062915(methyl (2R)-phenyl[(2R)-piperidin-2-yl]acetate | m...)
Affinity DataIC50: 989nMAssay Description:Selectivity for the norepinephrine transporter using [3H]nisoxetine binding assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/13/2012
Entry Details Article
PubMed
TargetD(1A)/D(1B)/D(2)/D(3)/D(4) dopamine receptor(Rat)
State University of New York

Curated by ChEMBL
LigandPNGBDBM50062915(methyl (2R)-phenyl[(2R)-piperidin-2-yl]acetate | m...)
Affinity DataIC50: 83nMAssay Description:Potency of inhibiting [3H]WIN-35428 binding to dopamine receptor in rat striatal membranesMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetD(1A)/D(1B)/D(2)/D(3)/D(4) dopamine receptor(Rat)
State University of New York

Curated by ChEMBL
LigandPNGBDBM50062915(methyl (2R)-phenyl[(2R)-piperidin-2-yl]acetate | m...)
Affinity DataIC50: 164nMAssay Description:Potency of inhibiting 10 pM [125I]-RTI-55 binding to dopamine receptor in rat striatal membranesMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetSodium-dependent dopamine transporter(Human)
Organix

Curated by ChEMBL
LigandPNGBDBM50062915(methyl (2R)-phenyl[(2R)-piperidin-2-yl]acetate | m...)
Affinity DataKi:  16nMAssay Description:Displacement of [3H]WIN-35,428 from human DAT expressed in mouse N2A cells after 15 mins by liquid scintillation countingMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/8/2013
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetSodium-dependent dopamine transporter(Human)
Organix

Curated by ChEMBL
LigandPNGBDBM50062915(methyl (2R)-phenyl[(2R)-piperidin-2-yl]acetate | m...)
Affinity DataKi:  25nMAssay Description:Displacement of [3H]WIN-35428 from human DAT stably expressed in mouse N2A cells by scintillation countnigMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/22/2011
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetSodium-dependent dopamine transporter(Rat)
Institute of Technology

Curated by ChEMBL
LigandPNGBDBM50062915(methyl (2R)-phenyl[(2R)-piperidin-2-yl]acetate | m...)
Affinity DataKi:  125nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/6/2012
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetNorepinephrine transporter(Rat)
Harvard University

Curated by PDSP Ki Database
LigandPNGBDBM50062915(methyl (2R)-phenyl[(2R)-piperidin-2-yl]acetate | m...)
Affinity DataKi:  126nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/6/2012
Entry Details Article
PubMed
TargetSodium-dependent serotonin transporter(Rat)
Georgia Institute of Technology

Curated by ChEMBL
LigandPNGBDBM50062915(methyl (2R)-phenyl[(2R)-piperidin-2-yl]acetate | m...)
Affinity DataKi: >1.00E+4nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/6/2012
Entry Details Article
PubMed