BDBM50089029 (8R,13R)-13-[(S)-2-Acetylamino-3-(4-hydroxy-phenyl)-propionylamino]-6,14-dioxo-10,11-dithia-7,15-diaza-spiro[4.12]heptadecane-8-carboxylic acid::CHEMBL16710

SMILES CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H]1CSSC[C@H](NC(=O)C2(CCCC2)CCNC1=O)C(O)=O

InChI Key InChIKey=NIIOQEIZEWMBBI-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 = 50089029   

TargetIntegrin alpha-4(Human)
Roche Research Center

Curated by ChEMBL
LigandPNGBDBM50089029((8R,13R)-13-[(S)-2-Acetylamino-3-(4-hydroxy-phenyl...)
Affinity DataIC50: 0.700nMAssay Description:Inhibition of VLA-4 binding to recombinant human VCAM using Solid phase assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetIntegrin alpha-4(Human)
Roche Research Center

Curated by ChEMBL
LigandPNGBDBM50089029((8R,13R)-13-[(S)-2-Acetylamino-3-(4-hydroxy-phenyl...)
Affinity DataIC50: 12nMAssay Description:Inhibition of VLA-4 binding to recombinant human VCAM using Ramos cell assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed