BDBM50394079 CHEMBL2158581

SMILES Cc1ccc(c(c1)C)c2c3c(c[nH]c3nc(n2)SC)C#N

InChI Key InChIKey=LXUVFEGNZXPXCA-UHFFFAOYSA-N

Data  1 KI

PDB links: 1 PDB ID matches this monomer.

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50394079   

TargetHeat shock protein HSP 90-beta(Human)
Vernalis

Curated by ChEMBL
LigandPNGBDBM50394079(CHEMBL2158581)
Affinity DataKi:  195nMAssay Description:Inhibition of fluorescently labeled VER51001 binding to full length human HSP90beta after 30 mins by fluorescence polarization assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/17/2013
Entry Details Article
PubMedPDB3D3D Structure (crystal)