BDBM50124287 2-{[4-((S)-Benzenesulfonyl)-1-methyl-piperidine-4-carbonyl]-amino}-3-(2'-methoxy-biphenyl-4-yl)-propionic acid::CHEMBL171284

SMILES COc1ccccc1-c1ccc(C[C@H](NC(=O)C2(CCN(C)CC2)S(=O)(=O)c2ccccc2)C(O)=O)cc1

InChI Key InChIKey=ILKTTWKSRXZSRE-UHFFFAOYSA-N

Data  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 2 hits for monomerid = 50124287   

TargetIntegrin alpha-4/beta-1(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50124287(2-{[4-((S)-Benzenesulfonyl)-1-methyl-piperidine-4-...)
Affinity DataIC50: 3nMAssay Description:Binding affinity towards VLA-4 (alpha4 beta-1) receptor in human Jurkat cells using [125I]VCAM-Ig as radioligandMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetIntegrin alpha-4/beta-7(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50124287(2-{[4-((S)-Benzenesulfonyl)-1-methyl-piperidine-4-...)
Affinity DataIC50: 2.00E+3nMAssay Description:Binding affinity towards VLA-4 (alpha4 beta7) receptor in human RPMI-8866 B-cell line using [125I]MAdCAM-Ig as radioligandMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed