BDBM50106901 CHEMBL104954::N-[(E)-(R)-1-(4-Chloro-benzyl)-3-((R)-2-oxo-azepan-3-ylcarbamoyl)-allyl]-N-methyl-3,5-bis-trifluoromethyl-benzamide

SMILES CN([C@H](Cc1ccc(Cl)cc1)\C=C\C(=O)N[C@@H]1CCCCNC1=O)C(=O)c1cc(cc(c1)C(F)(F)F)C(F)(F)F

InChI Key InChIKey=ATMHFQDWDFHUDF-UHFFFAOYSA-N

Data  4 IC50

  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 4 hits for monomerid = 50106901   

TargetSubstance-K receptor(Human)
Novartis Pharma

Curated by ChEMBL
LigandPNGBDBM50106901(N-[(E)-(R)-1-(4-Chloro-benzyl)-3-((R)-2-oxo-azepan...)
Affinity DataIC50: 24nMAssay Description:In vitro inhibition of [125I]NKA binding to transfected Chinese hamster ovary cells (CHO cells) expressing recombinant human Tachykinin receptor 2More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetSubstance-P receptor(Human)
Novartis Pharma

Curated by ChEMBL
LigandPNGBDBM50106901(N-[(E)-(R)-1-(4-Chloro-benzyl)-3-((R)-2-oxo-azepan...)
Affinity DataIC50: 0.5nMAssay Description:In vitro inhibition of [3H]Sar9-substance P binding to Tachykinin receptor 1 in bovine retinal membranesMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetSubstance-K receptor(Human)
Novartis Pharma

Curated by ChEMBL
LigandPNGBDBM50106901(N-[(E)-(R)-1-(4-Chloro-benzyl)-3-((R)-2-oxo-azepan...)
Affinity DataIC50: 24nMAssay Description:In vitro binding affinity for Tachykinin receptor 2 of human-CHO cells using 125 I-NKA radioligandMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetSubstance-P receptor(Human)
Novartis Pharma

Curated by ChEMBL
LigandPNGBDBM50106901(N-[(E)-(R)-1-(4-Chloro-benzyl)-3-((R)-2-oxo-azepan...)
Affinity DataIC50: 0.5nMAssay Description:In vitro binding affinity for Tachykinin receptor 1 of bovine retinal membranes using [3H]Sar9-substance P as radioligandMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed