BDBM23862 Peptidyl alpha-Ketoester, 1d::methyl 3-[(2S)-2-(3,3-diphenylpropanamido)-4-methylpentanamido]-2-oxo-4-phenylbutanoate

SMILES COC(=O)C(=O)C(Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)CC(c1ccccc1)c1ccccc1

InChI Key InChIKey=KEYVXBPTASBLDW-UHFFFAOYSA-N

Data  1 KI

  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 1 hit for monomerid = 23862   

TargetCalpain-1 catalytic subunit(Pig)
University of Tennessee Health Science Center

LigandPNGBDBM23862(methyl 3-[(2S)-2-(3,3-diphenylpropanamido)-4-methy...)
Affinity DataKi:  2.15E+3nM ΔG°:  -7.65kcal/molepH: 7.4 T: 2°CAssay Description:Assays were initiated by addition of CaCl2, and the increase in fluorescence (ex @370 nm, em @440 nm) was monitored. MDL28170 and buffer with 2% DMSO...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/4/2008
Entry Details Article
PubMed