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SMILES: CC(C)c1cc(-c2nnc(Nc3cccc(N)c3)n2-c2ccc3n(C)ccc3c2)c(O)cc1O

InChI Key: InChIKey=FCCBATACBZGWEY-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 131787   
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))		BDBM131787
PNG
(US8835464, 6a)
Show SMILES CC(C)c1cc(-c2nnc(Nc3cccc(N)c3)n2-c2ccc3n(C)ccc3c2)c(O)cc1O
Show InChI InChI=1S/C26H26N6O2/c1-15(2)20-13-21(24(34)14-23(20)33)25-29-30-26(28-18-6-4-5-17(27)12-18)32(25)19-7-8-22-16(11-19)9-10-31(22)3/h4-15,33-34H,27H2,1-3H3,(H,28,30)
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MMDB

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Similars
US Patent
n/an/a 2.90E+3n/an/an/an/an/an/a



Synta Pharmaceuticals Corp.

US Patent


Assay Description
Hsp90 protein is obtained from Stressgen (Cat#SPP-770). Assay buffer: 100 mM Tris-HCl, Ph7.4, 20 mM KCl, 6 mM MgCl2. Malachite green (0.0812% w/v) (M...

US Patent US8835464 (2014)


BindingDB Entry DOI: 10.7270/Q2J38R7W
More data for this
Ligand-Target Pair