Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'DNA topoisomerase 2-beta' and Ligand = 'BDBM50449891'   

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-beta (Homo sapiens (Human))	BDBM50449891 (CHEMBL4174756) Show SMILES COc1cc(cc(OC)c1OC)C1=N\C(=C/c2cc(Br)cc(Br)c2OC(C)=O)C(=O)NN1c1ccccc1 |t:13| Show InChI InChI=1S/C27H23Br2N3O6/c1-15(33)38-24-16(10-18(28)14-20(24)29)11-21-27(34)31-32(19-8-6-5-7-9-19)26(30-21)17-12-22(35-2)25(37-4)23(13-17)36-3/h5-14H,1-4H3,(H,31,34)/b21-11-	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank 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
Port Said University Curated by ChEMBL					Assay Description Inhibition of human DNA topoisomerase 2beta after 2 hrs by ELISA				Eur J Med Chem 156: 563-579 (2018) Article DOI: 10.1016/j.ejmech.2018.07.003 BindingDB Entry DOI: 10.7270/Q20G3NPD
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