BDBM50290297 1-{2-[(R)-3-(3,4-Dichloro-phenyl)-1-(3,4,5-trimethoxy-benzoyl)-pyrrolidin-3-yl]-ethyl}-4-phenyl-piperidine-4-carboxylic acid amide; hydrochloride::CHEMBL539021::MDL 103,392A racemate

SMILES COc1cc(cc(OC)c1OC)C(=O)N1CC[C@@](CCN2CCC(CC2)(C(N)=O)c2ccccc2)(C1)c1ccc(Cl)c(Cl)c1

InChI Key InChIKey=WZMVQZJKOVPVGZ-UHFFFAOYSA-N

Data  4 KI  2 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 6 hits for monomerid = 50290297   

TargetSubstance-P receptor(Guinea pig)
TBA

Curated by ChEMBL
LigandPNGBDBM50290297(CHEMBL539021 | MDL 103,392A racemate | 1-{2-[(R)-3...)
Affinity DataIC50: 3.10nMAssay Description:Binding affinity for NK1 receptor in guinea pig lung was determined by using [125 I]-Bolton Hunter labeled SPMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/22/2010
Entry Details Article

TargetSubstance-K receptor(Mouse)
TBA

Curated by ChEMBL
LigandPNGBDBM50290297(CHEMBL539021 | MDL 103,392A racemate | 1-{2-[(R)-3...)
Affinity DataIC50: 8.40nMAssay Description:Binding affinity for NK2 receptor in HSKR-1 cells was determined by using [125 I ]-Iodohistidyl NKA.More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/22/2010
Entry Details Article

TargetSubstance-P receptor(Guinea pig)
TBA

Curated by ChEMBL
LigandPNGBDBM50290297(CHEMBL539021 | MDL 103,392A racemate | 1-{2-[(R)-3...)
Affinity DataKi:  5.88nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/21/2012
Entry Details
PubMed
TargetSubstance-P receptor(Human)
Hoechst Marion Roussel

Curated by PDSP Ki Database
LigandPNGBDBM50290297(CHEMBL539021 | MDL 103,392A racemate | 1-{2-[(R)-3...)
Affinity DataKi:  7.07nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/21/2012
Entry Details
PubMed
TargetSubstance-K receptor(Human)
Hoechst Marion Roussel

Curated by PDSP Ki Database
LigandPNGBDBM50290297(CHEMBL539021 | MDL 103,392A racemate | 1-{2-[(R)-3...)
Affinity DataKi:  21nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/21/2012
Entry Details
PubMed
TargetNeuromedin-K receptor(Guinea pig)
Hoechst Marion Roussel

Curated by PDSP Ki Database
LigandPNGBDBM50290297(CHEMBL539021 | MDL 103,392A racemate | 1-{2-[(R)-3...)
Affinity DataKi:  54.3nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/21/2012
Entry Details
PubMed