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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 = 'BDBM50328434'   
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))		BDBM50328434
PNG
(3-bromo-N-(4-morpholinophenyl)-6-(pyridin-3-yl)imi...)
Show SMILES Brc1cnc2c(Nc3ccc(cc3)N3CCOCC3)nc(cn12)-c1cccnc1
Show InChI InChI=1S/C21H19BrN6O/c22-19-13-24-21-20(26-18(14-28(19)21)15-2-1-7-23-12-15)25-16-3-5-17(6-4-16)27-8-10-29-11-9-27/h1-7,12-14H,8-11H2,(H,25,26)
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Similars
Article
PubMed
n/an/a 152n/an/an/an/an/an/a



Institute of Cancer Research

Curated by ChEMBL


Assay Description
Inhibition of human aurora A

Bioorg Med Chem Lett 20: 5988-93 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.091
BindingDB Entry DOI: 10.7270/Q2H995D7
More data for this
Ligand-Target Pair