BDBM50270311 3-[1'-{2'-(4''-Ethylbenzoate)}-ethynyl]-3-quinuclidinol::CHEMBL443678

SMILES CCOC(=O)c1ccc(cc1)C#CC1(O)CN2CCC1CC2

InChI Key InChIKey=MDVVVQXRYFFKIA-UHFFFAOYSA-N

Data  1 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 1 hit for monomerid = 50270311   

TargetSqualene synthase(Leishmania major)
Cardiff University

Curated by ChEMBL
LigandPNGBDBM50270311(3-[1'-{2'-(4''-Ethylbenzoate)}-ethynyl]-3-quinucli...)
Affinity DataIC50: 4.25E+3nMAssay Description:Inhibition of Leishmania major recombinant squalene synthase expressed in Escherichia coli by liquid scintillation counterMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed