Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Aurora kinase A' and Ligand = 'BDBM50479521'   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Aurora kinase A (Homo sapiens (Human))	BDBM50479521 (CHEMBL461785) Show SMILES COc1ccc(\C=N\Nc2[nH]nc(C)c2C(=O)NCc2cccc(OC)c2)cc1 Show InChI InChI=1S/C21H23N5O3/c1-14-19(21(27)22-12-16-5-4-6-18(11-16)29-3)20(26-24-14)25-23-13-15-7-9-17(28-2)10-8-15/h4-11,13H,12H2,1-3H3,(H,22,27)(H2,24,25,26)/b23-13+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	838	n/a	n/a	n/a	n/a	n/a	n/a
National Health Research Institutes Curated by ChEMBL					Assay Description Inhibition of Aurora kinase A T288D mutant expressed in Escherichia coli BL21 DE3				J Med Chem 52: 1050-62 (2009) Article DOI: 10.1021/jm801270e BindingDB Entry DOI: 10.7270/Q27M0BQJ
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