BDBM50298028 (S)-2-chloro-4-((1-methylpyrrolidin-3-yl)(2-(trifluoromethyl)benzyl)amino)benzonitrile::2-chloro-4-{[(3S)-1-methylpyrrolidin-3-yl][2-(trifluoromethyl)benzyl]amino}benzonitrile::CHEMBL558664

SMILES C[N@]1CC[C@@H](C1)N(Cc2ccccc2C(F)(F)F)c3ccc(c(c3)Cl)C#N

InChI Key InChIKey=HMOAZJHSXXENHE-UHFFFAOYSA-N

Data  7 IC50  5 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 12 hits for monomerid = 50298028   

TargetProgesterone receptor(Human)
Glaxosmithkline

Curated by ChEMBL
LigandPNGBDBM50298028(2-chloro-4-{[(3S)-1-methylpyrrolidin-3-yl][2-(trif...)
Affinity DataIC50: 16nMAssay Description:Binding affinity to PR by fluorescence polarization based competition binding assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/27/2010
Entry Details Article
PubMed
TargetProgesterone receptor(Human)
Glaxosmithkline

Curated by ChEMBL
LigandPNGBDBM50298028(2-chloro-4-{[(3S)-1-methylpyrrolidin-3-yl][2-(trif...)
Affinity DataEC50:  3nMAssay Description:Agonist activity at PR expressed in african green monkey CV-1 cells by luciferase reporter assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/27/2010
Entry Details Article
PubMed
TargetProgesterone receptor(Human)
Glaxosmithkline

Curated by ChEMBL
LigandPNGBDBM50298028(2-chloro-4-{[(3S)-1-methylpyrrolidin-3-yl][2-(trif...)
Affinity DataEC50:  9nMAssay Description:Agonist activity at PR expressed in human T47D cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/27/2010
Entry Details Article
PubMed
TargetAndrogen receptor(Human)
Glaxosmithkline

Curated by ChEMBL
LigandPNGBDBM50298028(2-chloro-4-{[(3S)-1-methylpyrrolidin-3-yl][2-(trif...)
Affinity DataIC50: 250nMAssay Description:Binding affinity to AR by fluorescence polarization based competition binding assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/27/2010
Entry Details Article
PubMed
TargetEstrogen receptor beta(Human)
Glaxosmithkline

Curated by ChEMBL
LigandPNGBDBM50298028(2-chloro-4-{[(3S)-1-methylpyrrolidin-3-yl][2-(trif...)
Affinity DataIC50: 1.00E+4nMAssay Description:Binding affinity to ERbeta by fluorescence polarization based competition binding assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/27/2010
Entry Details Article
PubMed
TargetMineralocorticoid receptor(Human)
Glaxosmithkline

Curated by ChEMBL
LigandPNGBDBM50298028(2-chloro-4-{[(3S)-1-methylpyrrolidin-3-yl][2-(trif...)
Affinity DataEC50:  5.00E+3nMAssay Description:Agonist activity at MR expressed in african green monkey CV-1 cells by luciferase reporter assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/27/2010
Entry Details Article
PubMed
TargetGlucocorticoid receptor(Human)
Glaxosmithkline

Curated by ChEMBL
LigandPNGBDBM50298028(2-chloro-4-{[(3S)-1-methylpyrrolidin-3-yl][2-(trif...)
Affinity DataEC50:  7.90E+3nMAssay Description:Antagonist activity at GR expressed in human A549 cell lineMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/27/2010
Entry Details Article
PubMed
TargetProgesterone receptor(Human)
Glaxosmithkline

Curated by ChEMBL
LigandPNGBDBM50298028(2-chloro-4-{[(3S)-1-methylpyrrolidin-3-yl][2-(trif...)
Affinity DataEC50:  9nMAssay Description:Agonist activity at PR in human T47D cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/31/2010
Entry Details Article
PubMed
TargetPotassium voltage-gated channel subfamily H member 2(Human)
Glaxosmithkline

Curated by ChEMBL
LigandPNGBDBM50298028(2-chloro-4-{[(3S)-1-methylpyrrolidin-3-yl][2-(trif...)
Affinity DataIC50: 780nMAssay Description:Inhibition of human ERG by patch clamp techniqueMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/31/2010
Entry Details Article
PubMed
TargetProgesterone receptor(Human)
Glaxosmithkline

Curated by ChEMBL
LigandPNGBDBM50298028(2-chloro-4-{[(3S)-1-methylpyrrolidin-3-yl][2-(trif...)
Affinity DataIC50: 16nMAssay Description:Inhibition of PRMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/31/2010
Entry Details Article
PubMed
TargetCytochrome P450 2D6(Human)
Glaxosmithkline

Curated by ChEMBL
LigandPNGBDBM50298028(2-chloro-4-{[(3S)-1-methylpyrrolidin-3-yl][2-(trif...)
Affinity DataIC50: 1.60E+3nMAssay Description:Inhibition of CYP2D6More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/31/2010
Entry Details Article
PubMed
TargetCytochrome P450 2C9(Human)
Glaxosmithkline

Curated by ChEMBL
LigandPNGBDBM50298028(2-chloro-4-{[(3S)-1-methylpyrrolidin-3-yl][2-(trif...)
Affinity DataIC50: 1.10E+3nMAssay Description:Inhibition of CYP2C9More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/31/2010
Entry Details Article
PubMed