Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Aurora kinase B' and Ligand = 'BDBM50460784'   

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))	BDBM50460784 (CHEMBL4227029) Show SMILES Cc1cn2c(cnc2c(Nc2cc(ns2)C(NC2CCCC2)c2ccccn2)n1)-c1cn[nH]c1 Show InChI InChI=1S/C24H25N9S/c1-15-14-33-20(16-11-27-28-12-16)13-26-24(33)23(29-15)31-21-10-19(32-34-21)22(18-8-4-5-9-25-18)30-17-6-2-3-7-17/h4-5,8-14,17,22,30H,2-3,6-7H2,1H3,(H,27,28)(H,29,31)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	<13	n/a	n/a	n/a	n/a	n/a	n/a
Merck & Co. Curated by ChEMBL					Assay Description Inhibition of Aurora B (unknown origin) using Tamra-PKAtide as substrate by fluorescence polarization assay				Bioorg Med Chem Lett 28: 1397-1403 (2018) Article DOI: 10.1016/j.bmcl.2018.02.037 BindingDB Entry DOI: 10.7270/Q2K35X91
					More data for this Ligand-Target Pair
Aurora kinase B (Homo sapiens (Human))	BDBM50460784 (CHEMBL4227029) Show SMILES Cc1cn2c(cnc2c(Nc2cc(ns2)C(NC2CCCC2)c2ccccn2)n1)-c1cn[nH]c1 Show InChI InChI=1S/C24H25N9S/c1-15-14-33-20(16-11-27-28-12-16)13-26-24(33)23(29-15)31-21-10-19(32-34-21)22(18-8-4-5-9-25-18)30-17-6-2-3-7-17/h4-5,8-14,17,22,30H,2-3,6-7H2,1H3,(H,27,28)(H,29,31)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	<16	n/a	n/a	n/a	n/a
Merck & Co. Curated by ChEMBL					Assay Description Inhibition of Aurora B in human HCT116 cells assessed as reduction in phosphorylation of Histone H3 at Ser10 residue incubated for 1 hr by Hoechst 33...				Bioorg Med Chem Lett 28: 1397-1403 (2018) Article DOI: 10.1016/j.bmcl.2018.02.037 BindingDB Entry DOI: 10.7270/Q2K35X91
					More data for this Ligand-Target Pair