BDBM23858 Peptidyl alpha-Ketoester, 1b::methyl 3-[(2S)-2-[1-(adamantan-1-yl)acetamido]-4-methylpentanamido]-2-oxo-4-phenylbutanoate

SMILES COC(=O)C(=O)C(Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)CC12CC3CC(CC(C3)C1)C2

InChI Key InChIKey=SZCTXKIVJORGPF-JQDMVOQTSA-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 = 23858   

TargetCalpain-1 catalytic subunit(Sus scrofa (pig))
University of Tennessee Health Science Center

LigandPNGBDBM23858(Peptidyl alpha-Ketoester, 1b | methyl 3-[(2S)-2-[1...)
Affinity DataKi:  450nM ΔG°:  -8.57kcal/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 DepthDetails ArticlePubMed