Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'DNA topoisomerase 1' and Ligand = 'BDBM50080279'   

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 1 (Homo sapiens (Human))	BDBM50080279 (6-(1-Hydroxy-pentyl)-5,8-dimethoxy-[1,4]naphthoqui...) Show SMILES CCCCC(O)c1cc(OC)c2C(=O)C=CC(=O)c2c1OC |c:14| Show InChI InChI=1S/C17H20O5/c1-4-5-6-11(18)10-9-14(21-2)15-12(19)7-8-13(20)16(15)17(10)22-3/h7-9,11,18H,4-6H2,1-3H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	8.31E+4	n/a	n/a	n/a	n/a	n/a	n/a
Chungnam National University Curated by ChEMBL					Assay Description Compound was evaluated for the inhibition of DNA topoisomerase-I of calf thymus				Bioorg Med Chem Lett 9: 2407-12 (1999) BindingDB Entry DOI: 10.7270/Q2TH8KVH
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