BDBM50079828 CHEMBL63933::[(S)-1-(1-{(S)-1-[((S)-(S)-1-Carbamoyl-3-methyl-butylamino)-methyl]-butylcarbamoyl}-4-guanidino-butylcarbamoyl)-2-phenyl-ethyl]-carbamic acid ethyl ester

SMILES CCC[C@@H](CN[C@@H](CC(C)C)C(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCC

InChI Key InChIKey=WKKVENFDVXPGQK-UHFFFAOYSA-N

Data  1 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 1 hit for monomerid = 50079828   

TargetH2-K region expressed gene 2, rat orthologue(Rat)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50079828([(S)-1-(1-{(S)-1-[((S)-(S)-1-Carbamoyl-3-methyl-bu...)
Affinity DataIC50: 1.20E+3nMAssay Description:Ability to inhibit binding of biotinylated rat myelin basic protein 13-mer peptide (RMBP 90-102, Major histocompatibility complex class II to purifie...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed