Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'DNA topoisomerase 2-alpha/2-beta' and Ligand = 'BDBM50474905'   

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/2-beta (Homo sapiens (Human))	BDBM50474905 (CHEMBL426087) Show SMILES [H][C@@]1(CC[C@]2(C)C3CCC4C(C)(C)C(=O)C(=C[C@]4(C)C3=CC[C@]12C)C(=O)OC)[C@H](C)CC[C@@H](O)C(C)(C)O |c:15,21| Show InChI InChI=1S/C32H50O5/c1-19(10-13-25(33)29(4,5)36)21-14-16-32(8)23-11-12-24-28(2,3)26(34)20(27(35)37-9)18-30(24,6)22(23)15-17-31(21,32)7/h15,18-19,21,23-25,33,36H,10-14,16-17H2,1-9H3/t19-,21-,23?,24?,25-,30-,31-,32-/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.65E+4	n/a	n/a	n/a	n/a	n/a	n/a
Osaka University of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Inhibitory concentration against human DNA topoisomerase II				Bioorg Med Chem Lett 15: 2966-9 (2005) Article DOI: 10.1016/j.bmcl.2005.04.052 BindingDB Entry DOI: 10.7270/Q2NZ8BDQ
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