BDBM50109900 (S)-3-Benzo[1,3]dioxol-5-yl-3-{(S)-4-methyl-2-[4-(3-o-tolyl-ureido)-benzylamino]-pentanoylamino}-propionic acid::CHEMBL156875

SMILES CC(C)C[C@H](NCc1ccc(NC(=O)Nc2ccccc2C)cc1)C(=O)N[C@@H](CC(O)=O)c1ccc2OCOc2c1

InChI Key InChIKey=MKCISCXMJCFWLW-UHFFFAOYSA-N

Data  1 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 1 hit for monomerid = 50109900   

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

Curated by ChEMBL
LigandPNGBDBM50109900((S)-3-Benzo[1,3]dioxol-5-yl-3-{(S)-4-methyl-2-[4-(...)
Affinity DataIC50: 3nMAssay Description:Inhibitory activity against alpha-4 beta-1 receptor (VLA-4) in human RPMI-8866 cells using [125I]-VCAM-Ig ligandMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed