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SMILES: Cc1cc(CN2CCN(CC2)c2c(Cl)cnc3nc([nH]c23)-c2ccn(C)n2)no1

InChI Key: InChIKey=MASXYJLOEJLQLX-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50401424   
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
Aurora kinase A


(Homo sapiens (Human))		BDBM50401424
PNG
(CHEMBL2207512)
Show SMILES Cc1cc(CN2CCN(CC2)c2c(Cl)cnc3nc([nH]c23)-c2ccn(C)n2)no1
Show InChI InChI=1S/C19H21ClN8O/c1-12-9-13(25-29-12)11-27-5-7-28(8-6-27)17-14(20)10-21-19-16(17)22-18(23-19)15-3-4-26(2)24-15/h3-4,9-10H,5-8,11H2,1-2H3,(H,21,22,23)
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Similars
Article
PubMed
n/an/a 118n/an/an/an/an/an/a



The Institute of Cancer Research

Curated by ChEMBL


Assay Description
Binding affinity to Aurora A kinase

J Med Chem 55: 8721-34 (2012)


Article DOI: 10.1021/jm300952s
BindingDB Entry DOI: 10.7270/Q22J6D2W
More data for this
Ligand-Target Pair