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Compile Data Set for Download or QSAR

Found 1 hit of kd for monomerid = 81731   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Heat shock protein HSP 90-alpha/90-beta


(Homo sapiens (Human))		BDBM81731
PNG
(HSP90 Inhibitor, 5)
Show SMILES Nc1nc(Cl)cc(n1)-c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C10H6Cl3N3/c11-5-1-2-6(7(12)3-5)8-4-9(13)16-10(14)15-8/h1-4H,(H2,14,15,16)
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n/an/an/a 12n/an/an/an/an/a



Astex Therapeutics, Ltd.

Curated by ChEMBL


Assay Description
Binding affinity to human N-terminal ATPase domain of Hsp90 by isothermal titration calorimetry

J Med Chem 53: 5942-55 (2010)


Article DOI: 10.1021/jm100059d
BindingDB Entry DOI: 10.7270/Q2QF8WPC
More data for this
Ligand-Target Pair