BDBM50157453 2-{3-[Benzyl-(2,2-dimethyl-propionyl)-amino]-phenyl}-3-[4-(2,6-dichloro-benzoylamino)-phenyl]-propionic acid::CHEMBL180719

SMILES CC(C)(C)C(=O)N(Cc1ccccc1)c1cccc(c1)C(Cc1ccc(NC(=O)c2c(Cl)cccc2Cl)cc1)C(O)=O

InChI Key InChIKey=ONPSCSQTOAOZKE-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50157453   

TargetIntegrin alpha-4/beta-1(Human)
Kaken Pharmaceutical

Curated by ChEMBL
LigandPNGBDBM50157453(2-{3-[Benzyl-(2,2-dimethyl-propionyl)-amino]-pheny...)
Affinity DataIC50: 5.80E+3nMAssay Description:Inhibition of Very late antigen-4 (VLA-4) expressing human leukemia cells (HL-60) aggregation with human Vascular cell adhesion molecule-1 (VCAM-1) e...More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/23/2013
Entry Details Article
PubMed