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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Aurora kinase A' and Ligand = 'BDBM50181535'   
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
Aurora kinase A


(Homo sapiens (Human))		BDBM50181535
PNG
(CHEMBL201655 | N-(5-butyl-1,3-thiazol-2-yl)-6-meth...)
Show SMILES CCCCc1cnc(Nc2ncnc3cc(OCCCN4CCOCC4)c(OC)cc23)s1
Show InChI InChI=1S/C23H31N5O3S/c1-3-4-6-17-15-24-23(32-17)27-22-18-13-20(29-2)21(14-19(18)25-16-26-22)31-10-5-7-28-8-11-30-12-9-28/h13-16H,3-12H2,1-2H3,(H,24,25,26,27)
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Similars
Article
PubMed
n/an/a 6n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
In vitro inhibition constant for Aurora-A

J Med Chem 49: 955-70 (2006)


Article DOI: 10.1021/jm050786h
BindingDB Entry DOI: 10.7270/Q24J0FXV
More data for this
Ligand-Target Pair