BDBM50123241 (S)-2-[(3S,5R)-3-Isobutyl-5-methyl-2-oxo-4-(2-quinolin-3-yl-acetyl)-[1,4]diazepan-1-yl]-3-naphthalen-2-yl-propionamide::CHEMBL359425

SMILES CC(C)C[C@@H]1N([C@H](C)CCN([C@@H](Cc2ccc3ccccc3c2)C(N)=O)C1=O)C(=O)Cc1cnc2ccccc2c1

InChI Key InChIKey=LGJZQZFSGWSQNO-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 50123241   

TargetIntegrin alpha-L/Intercellular adhesion molecule 1(Human)
Novartis Institutes For Biomedical Research

Curated by ChEMBL
LigandPNGBDBM50123241((S)-2-[(3S,5R)-3-Isobutyl-5-methyl-2-oxo-4-(2-quin...)
Affinity DataIC50: 70nMAssay Description:In vitro inhibitory concentration for Lymphocyte function associated antigen 1/Intercellular adhesion molecule 1 (LFA-1/ICAM-1)More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetIntegrin alpha-L/Integrin beta-2/Intercellular adhesion molecule 1(Human)
Novartis Institute For Biomedical Research

Curated by ChEMBL
LigandPNGBDBM50123241((S)-2-[(3S,5R)-3-Isobutyl-5-methyl-2-oxo-4-(2-quin...)
Affinity DataIC50: 70nMAssay Description:Inhibition of LFA-1/ICAM-1 interaction in ELISAMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed