BDBM50148347 4-[((S)-2-{(S)-4-[(3S,4S)-4-((S)-2-Acetylamino-4-methyl-pentanoylamino)-3-hydroxy-6-methyl-octanoylamino]-3-hydroxy-6-methanesulfinyl-hexanoylamino}-3-methyl-butyrylamino)-methyl]-benzoic acid::CHEMBL116826

SMILES CCC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(C)=O)[C@@H](O)CC(=O)NC(CCS(C)=O)[C@@H](O)CC(=O)N[C@@H](C(C)C)C(=O)NCc1ccc(cc1)C(O)=O

InChI Key InChIKey=VYTGBGCTBASQBI-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 = 50148347   

TargetBeta-secretase 1(Human)
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50148347(4-[((S)-2-{(S)-4-[(3S,4S)-4-((S)-2-Acetylamino-4-m...)
Affinity DataIC50: 3.40E+4nMAssay Description:Inhibition of human Beta-secretase 1More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed