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SMILES: CC1(C)Cc2c(c(nn2-c2ccc3c(N)ncnc3c2)C(F)(F)F)C(=O)C1

InChI Key: InChIKey=FWLCMMDYOTYCHR-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50379856   
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))		BDBM50379856
PNG
(CHEMBL2011857)
Show SMILES CC1(C)Cc2c(c(nn2-c2ccc3c(N)ncnc3c2)C(F)(F)F)C(=O)C1
Show InChI InChI=1S/C18H16F3N5O/c1-17(2)6-12-14(13(27)7-17)15(18(19,20)21)25-26(12)9-3-4-10-11(5-9)23-8-24-16(10)22/h3-5,8H,6-7H2,1-2H3,(H2,22,23,24)
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MMDB

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n/an/a 1.70E+4n/an/an/an/an/an/a



Serenex Inc.

Curated by ChEMBL


Assay Description
Inhibition of HSP90-mediated Her2 degradation in human AU565 cells after 24 hrs by ELISA

Bioorg Med Chem Lett 22: 2550-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.137
BindingDB Entry DOI: 10.7270/Q2WQ04TB
More data for this
Ligand-Target Pair