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SMILES: Oc1cc(O)c2C[C@H](OC(=O)c3ccccc3)[C@H](Oc2c1)c1ccccc1

InChI Key: InChIKey=AEHSIUQHVJBXBC-LEWJYISDSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50013713   
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))		BDBM50013713
PNG
(CHEMBL3264542)
Show SMILES Oc1cc(O)c2C[C@H](OC(=O)c3ccccc3)[C@H](Oc2c1)c1ccccc1 |r|
Show InChI InChI=1S/C22H18O5/c23-16-11-18(24)17-13-20(27-22(25)15-9-5-2-6-10-15)21(26-19(17)12-16)14-7-3-1-4-8-14/h1-12,20-21,23-24H,13H2/t20-,21+/m0/s1
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MMDB

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Article
PubMed
n/an/a 1.20E+5n/an/an/an/an/an/a



Montclair State University

Curated by ChEMBL


Assay Description
Inhibition of HSP90 (unknown origin) by luciferase refolding assay

Bioorg Med Chem Lett 24: 2263-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.03.088
BindingDB Entry DOI: 10.7270/Q2RF5WK6
More data for this
Ligand-Target Pair