BDBM50089000 (6S,9R,14R,16aS)-9-[(Adamantane-1-carbonyl)-amino]-6-carboxymethyl-8,16-dioxo-tetradecahydro-11,12-dithia-4a,7,15-triaza-benzocyclotetradecene-14-carboxylic acid::CHEMBL178796

SMILES OC(=O)C[C@H]1CN2CCCC[C@H]2C(=O)N[C@@H](CSSC[C@H](NC(=O)C23CC4CC(CC(C4)C2)C3)C(=O)N1)C(O)=O

InChI Key

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50089000   

TargetIntegrin alpha-4/beta-1(Human)
Celltech Chiroscience

Curated by ChEMBL
LigandPNGBDBM50089000((6S,9R,14R,16aS)-9-[(Adamantane-1-carbonyl)-amino]...)
Affinity DataIC50: 12nMAssay Description:Inhibition of VCAM (vascular cell adhesion molecule) adhesion to alpha4-beta1 integrin of leukocyte cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/22/2013
Entry Details Article
PubMed