BDBM50198922 2-((S)-2-(3,5-dichloro-N-methylphenylsulfonamido)-3-methylbutanamido)cyclohexanecarboxylic acid::CHEMBL439031

SMILES CC(C)[C@H](N(C)S(=O)(=O)c1cc(Cl)cc(Cl)c1)C(=O)NC1CCCCC1C(O)=O

InChI Key InChIKey=GATBHULWBRMIHA-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 = 50198922   

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

Curated by ChEMBL
LigandPNGBDBM50198922(2-((S)-2-(3,5-dichloro-N-methylphenylsulfonamido)-...)
Affinity DataIC50: 462nMAssay Description:Binding affinity to human VLA4 alpha4beta1 in Jurkat cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed