Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'DNA topoisomerase 2-alpha' and Ligand = 'BDBM50246436'   

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
DNA topoisomerase 2-alpha (Homo sapiens (Human))	BDBM50246436 (CHEMBL4090510) Show SMILES COc1cccc(NC(=O)c2c(O)n(-c3ccccc3)c(=S)n(-c3ccccc3)c2=O)c1 Show InChI InChI=1S/C24H19N3O4S/c1-31-19-14-8-9-16(15-19)25-21(28)20-22(29)26(17-10-4-2-5-11-17)24(32)27(23(20)30)18-12-6-3-7-13-18/h2-15,29H,1H3,(H,25,28)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.61E+4	n/a	n/a	n/a	n/a	n/a	n/a
Istituto Italiano di Tecnologia Curated by ChEMBL					Assay Description Inhibition of human topo2alpha incubated for 30 mins by SYBR safe DNA stain based decatenation assay				J Med Chem 63: 3508-3521 (2020) Article DOI: 10.1021/acs.jmedchem.9b01760 BindingDB Entry DOI: 10.7270/Q2251NHX
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DNA topoisomerase 2-alpha (Homo sapiens (Human))	BDBM50246436 (CHEMBL4090510) Show SMILES COc1cccc(NC(=O)c2c(O)n(-c3ccccc3)c(=S)n(-c3ccccc3)c2=O)c1 Show InChI InChI=1S/C24H19N3O4S/c1-31-19-14-8-9-16(15-19)25-21(28)20-22(29)26(17-10-4-2-5-11-17)24(32)27(23(20)30)18-12-6-3-7-13-18/h2-15,29H,1H3,(H,25,28)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Istituto Italiano di Tecnologia Curated by ChEMBL					Assay Description Inhibition of human topoisomerase 2alpha expressed in baculovirus-infected insect cells assessed as reduction in pBR322 supercoiled DNA relaxation af...				J Med Chem 61: 1375-1379 (2018) Article DOI: 10.1021/acs.jmedchem.7b01388 BindingDB Entry DOI: 10.7270/Q2B56N5T
					More data for this Ligand-Target Pair