BDBM50060177 (5S,8R,13R,15aS)-8-[(S)-2-((S)-2-Amino-3-phenyl-propionylamino)-5-guanidino-pentanoylamino]-5-carboxymethyl-4,7,15-trioxo-tetradecahydro-10,11-dithia-3a,6,14-triaza-cyclopentacyclotetradecene-13-carboxylic acid::CHEMBL324283

SMILES N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H]1CSSC[C@H](NC(=O)[C@@H]2CCCN2C(=O)[C@H](CC(O)=O)NC1=O)C(O)=O

InChI Key InChIKey=NXBKLUMFVXVAEX-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 = 50060177   

TargetIntegrin alpha-4/beta-1(Human)
Genentech

Curated by ChEMBL
LigandPNGBDBM50060177((5S,8R,13R,15aS)-8-[(S)-2-((S)-2-Amino-3-phenyl-pr...)
Affinity DataIC50: 2.10E+3nMAssay Description:Inhibition of purified alpha-4 beta-1 binding to VCAM-1 was determined in an ELISA assay.More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/22/2013
Entry Details Article
PubMed
TargetIntegrin alpha-4/beta-1(Human)
Genentech

Curated by ChEMBL
LigandPNGBDBM50060177((5S,8R,13R,15aS)-8-[(S)-2-((S)-2-Amino-3-phenyl-pr...)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of fluorescently labeled alpha4-beta1 positive Ramos cells binding to immobilized VCAM-1.More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/22/2013
Entry Details Article
PubMed