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SMILES: CN(Cc1ccccc1)C(=O)c1cc2c(Cc3ccccc3C)n[nH]c2cc1O

InChI Key: InChIKey=FDFPYOCFUPYRNC-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50386027   
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))		BDBM50386027
PNG
(CHEMBL2042866)
Show SMILES CN(Cc1ccccc1)C(=O)c1cc2c(Cc3ccccc3C)n[nH]c2cc1O
Show InChI InChI=1S/C24H23N3O2/c1-16-8-6-7-11-18(16)12-21-19-13-20(23(28)14-22(19)26-25-21)24(29)27(2)15-17-9-4-3-5-10-17/h3-11,13-14,28H,12,15H2,1-2H3,(H,25,26)
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Article
PubMed
n/an/a 2.40E+3n/an/an/an/an/an/a



Merck Serono Research

Curated by ChEMBL


Assay Description
Displacement of [3H]17AAG from human recombinant Hsp90 after 30 mins by beta scintillation counting

Bioorg Med Chem Lett 22: 4396-403 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.121
BindingDB Entry DOI: 10.7270/Q2T154QC
More data for this
Ligand-Target Pair