BDBM50226629 CHEMBL266647::N-(1S-[2-{4-[(2R)-methyl-3-(4-chlorophenyl)propionyl]-1-piperazinyl}-5-chlorophenyl]-3-methylbutyl)-3-(dimethylamino)propionamide

SMILES CC(C)C[C@H](NC(=O)CCN(C)C)c1cc(Cl)ccc1N1CCN(CC1)C(=O)[C@H](C)Cc1ccc(Cl)cc1

InChI Key InChIKey=NICHJJOSEXYBED-UHFFFAOYSA-N

Data  6 KI  6 IC50  1 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 13 hits for monomerid = 50226629   

TargetMelanocortin receptor 4(Human)
Neurocrine Biosciences

Curated by ChEMBL
LigandPNGBDBM50226629(N-(1S-[2-{4-[(2R)-methyl-3-(4-chlorophenyl)propion...)
Affinity DataIC50: 930nMAssay Description:Antagonist activity at human MC4R expressed in HEK293 cells assessed as inhibition of alpha-MSH-stimulated cAMP productionMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/11/2009
Entry Details Article
PubMed
TargetCytochrome P450 2C9(Human)
Neurocrine Biosciences

Curated by ChEMBL
LigandPNGBDBM50226629(N-(1S-[2-{4-[(2R)-methyl-3-(4-chlorophenyl)propion...)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of CYP2C9More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/11/2009
Entry Details Article
PubMed
TargetGrowth hormone secretagogue receptor type 1(Human)
Neurocrine Biosciences

Curated by ChEMBL
LigandPNGBDBM50226629(N-(1S-[2-{4-[(2R)-methyl-3-(4-chlorophenyl)propion...)
Affinity DataEC50:  720nMAssay Description:Agonist activity at GHSRMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/11/2009
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Neurocrine Biosciences

Curated by ChEMBL
LigandPNGBDBM50226629(N-(1S-[2-{4-[(2R)-methyl-3-(4-chlorophenyl)propion...)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of CYP3A4More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/11/2009
Entry Details Article
PubMed
TargetCytochrome P450 1A2(Human)
Neurocrine Biosciences

Curated by ChEMBL
LigandPNGBDBM50226629(N-(1S-[2-{4-[(2R)-methyl-3-(4-chlorophenyl)propion...)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of CYP1A2More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/11/2009
Entry Details Article
PubMed
TargetCytochrome P450 2D6(Human)
Neurocrine Biosciences

Curated by ChEMBL
LigandPNGBDBM50226629(N-(1S-[2-{4-[(2R)-methyl-3-(4-chlorophenyl)propion...)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of CYP2D6More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/11/2009
Entry Details Article
PubMed
TargetCytochrome P450 2C19(Human)
Neurocrine Biosciences

Curated by ChEMBL
LigandPNGBDBM50226629(N-(1S-[2-{4-[(2R)-methyl-3-(4-chlorophenyl)propion...)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of CYP2C19More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/11/2009
Entry Details Article
PubMed
TargetMelanocortin receptor 4(Human)
Neurocrine Biosciences

Curated by ChEMBL
LigandPNGBDBM50226629(N-(1S-[2-{4-[(2R)-methyl-3-(4-chlorophenyl)propion...)
Affinity DataKi:  3.40nMAssay Description:Displacement of [125I]NDPMSH from human MC4R expressed in HEK293 cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/11/2009
Entry Details Article
PubMed
TargetMelanocortin receptor 4(Mouse)
Neurocrine Biosciences

Curated by ChEMBL
LigandPNGBDBM50226629(N-(1S-[2-{4-[(2R)-methyl-3-(4-chlorophenyl)propion...)
Affinity DataKi:  18nMAssay Description:Binding affinity to mouse MC4RMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/11/2009
Entry Details Article
PubMed
TargetMelanocortin receptor 3(Mouse)
Neurocrine Biosciences

Curated by ChEMBL
LigandPNGBDBM50226629(N-(1S-[2-{4-[(2R)-methyl-3-(4-chlorophenyl)propion...)
Affinity DataKi:  340nMAssay Description:Binding affinity to mouse MC3RMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/11/2009
Entry Details Article
PubMed
TargetGrowth hormone secretagogue receptor type 1(Human)
Neurocrine Biosciences

Curated by ChEMBL
LigandPNGBDBM50226629(N-(1S-[2-{4-[(2R)-methyl-3-(4-chlorophenyl)propion...)
Affinity DataKi:  460nMAssay Description:Binding affinity to GHSRMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/11/2009
Entry Details Article
PubMed
TargetMelanocortin receptor 5(Human)
Neurocrine Biosciences

Curated by ChEMBL
LigandPNGBDBM50226629(N-(1S-[2-{4-[(2R)-methyl-3-(4-chlorophenyl)propion...)
Affinity DataKi:  600nMAssay Description:Displacement of [125I]NDPMSH from human MC5R expressed in HEK293 cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/11/2009
Entry Details Article
PubMed
TargetMelanocortin receptor 3(Human)
Neurocrine Biosciences

Curated by ChEMBL
LigandPNGBDBM50226629(N-(1S-[2-{4-[(2R)-methyl-3-(4-chlorophenyl)propion...)
Affinity DataKi:  710nMAssay Description:Displacement of [125I]NDPMSH from human MC3R expressed in HEK293 cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/11/2009
Entry Details Article
PubMed