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SMILES: CSc1nc(-c2ccc(C)cc2C)c2cc[nH]c2n1

InChI Key: InChIKey=DPIFHHMCXKKFSN-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50394082   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Heat shock protein HSP 90-beta


(Homo sapiens (Human))		BDBM50394082
PNG
(CHEMBL2158633)
Show SMILES CSc1nc(-c2ccc(C)cc2C)c2cc[nH]c2n1
Show InChI InChI=1S/C15H15N3S/c1-9-4-5-11(10(2)8-9)13-12-6-7-16-14(12)18-15(17-13)19-3/h4-8H,1-3H3,(H,16,17,18)
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Article
PubMed
>2.00E+5n/an/an/an/an/an/an/an/a



Vernalis Ltd.

Curated by ChEMBL


Assay Description
Inhibition of fluorescently labeled VER51001 binding to full length human HSP90beta after 30 mins by fluorescence polarization assay

Bioorg Med Chem 20: 6770-89 (2012)


Article DOI: 10.1016/j.bmc.2012.08.050
BindingDB Entry DOI: 10.7270/Q2KS6SN4
More data for this
Ligand-Target Pair