Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'DNA topoisomerase 2-alpha' and Ligand = 'BDBM50298272'   

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))	BDBM50298272 (CHEMBL575610 | N,N'-Bis(2-((2-(7-chloro-6-oxo-6H-d...) Show SMILES CN(CCNC(=O)CCC(=O)NCCN(C)CCn1nc2-c3cccc(Cl)c3C(=O)c3cccc1c23)CCn1nc2-c3cccc(Cl)c3C(=O)c3cccc1c23 Show InChI InChI=1S/C42H40Cl2N8O4/c1-49(21-23-51-31-13-5-9-27-37(31)39(47-51)25-7-3-11-29(43)35(25)41(27)55)19-17-45-33(53)15-16-34(54)46-18-20-50(2)22-24-52-32-14-6-10-28-38(32)40(48-52)26-8-4-12-30(44)36(26)42(28)56/h3-14H,15-24H2,1-2H3,(H,45,53)(H,46,54)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Manitoba Curated by ChEMBL					Assay Description Inhibition of decatenation activity of human topoisomerase 2alpha				Bioorg Med Chem 17: 4575-82 (2009) Article DOI: 10.1016/j.bmc.2009.04.072 BindingDB Entry DOI: 10.7270/Q28915XR
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