BDBM50117035 (S)-3-[4-(2,6-Dichloro-benzoylamino)-phenyl]-2-({1-[2-(2,2-dimethyl-propionylamino)-ethyl]-cyclopentanecarbonyl}-amino)-propionic acid::CHEMBL81989

SMILES CC(C)(C)C(=O)NCCC1(CCCC1)C(=O)N[C@@H](Cc1ccc(NC(=O)c2c(Cl)cccc2Cl)cc1)C(O)=O

InChI Key InChIKey=MMUKITGTIBVSEA-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 = 50117035   

TargetIntegrin alpha-4/beta-1(Human)
Roche Research Center

Curated by ChEMBL
LigandPNGBDBM50117035((S)-3-[4-(2,6-Dichloro-benzoylamino)-phenyl]-2-({1...)
Affinity DataIC50: 28nMAssay Description:Inhibitory binding concentration determined against VCAM/VLA-4 in RamosMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetIntegrin alpha-4/beta-1(Human)
Roche Research Center

Curated by ChEMBL
LigandPNGBDBM50117035((S)-3-[4-(2,6-Dichloro-benzoylamino)-phenyl]-2-({1...)
Affinity DataIC50: 1.20nMAssay Description:Inhibitory binding concentration determined against VCAM/VLA-4 in ELISAMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed