Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Aurora kinase B' and Ligand = 'BDBM50324275'   

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 B (Homo sapiens (Human))	BDBM50324275 ((Z)-5-(Indolin-1-ylsulfonyl)-3-{[3-(3-morpholino-3...) Show SMILES O=C(CCc1c(C=C2C(=O)Nc3ccc(cc23)S(=O)(=O)N2CCc3ccccc23)[nH]c2CCCC(=O)c12)N1CCOCC1 |w:6.5| Show InChI InChI=1S/C32H32N4O6S/c37-29-7-3-5-26-31(29)22(9-11-30(38)35-14-16-42-17-15-35)27(33-26)19-24-23-18-21(8-10-25(23)34-32(24)39)43(40,41)36-13-12-20-4-1-2-6-28(20)36/h1-2,4,6,8,10,18-19,33H,3,5,7,9,11-17H2,(H,34,39)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.15E+3	n/a	n/a	n/a	n/a	n/a	n/a
Development Center for Biotechnology Curated by ChEMBL					Assay Description Inhibition of recombinant aurora B				J Med Chem 53: 5929-41 (2010) Article DOI: 10.1021/jm1001869 BindingDB Entry DOI: 10.7270/Q2XS5VKS
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