Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'DNA topoisomerase I/type IB small subunit' and Ligand = 'BDBM246593'   

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 I/type IB small subunit (Leishmania donovani)	BDBM246593 (Bi-lawsone analog, 3c) Show SMILES COc1cc(ccc1O)C(C1=C(O)C(=O)c2ccccc2C1=O)C1=C(O)C(=O)c2ccccc2C1=O |c:11,26| Show InChI InChI=1S/C28H18O8/c1-36-19-12-13(10-11-18(19)29)20(21-23(30)14-6-2-4-8-16(14)25(32)27(21)34)22-24(31)15-7-3-5-9-17(15)26(33)28(22)35/h2-12,20,29,34-35H,1H3	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.40E+4	n/a	n/a	n/a	n/a	7.5	n/a
Karunya University					Assay Description In the preincubation assay, CPT concentrations were 50 and 100 μM, whereas various concentrations of compounds were 25, 50 and 100 μM. LdTOP1LS...				J Enzyme Inhib Med Chem 29: 185-9 (2014) Article DOI: 10.3109/14756366.2013.765413 BindingDB Entry DOI: 10.7270/Q2CJ8CDH
					More data for this Ligand-Target Pair
DNA topoisomerase I/type IB small subunit (Leishmania donovani)	BDBM246593 (Bi-lawsone analog, 3c) Show SMILES COc1cc(ccc1O)C(C1=C(O)C(=O)c2ccccc2C1=O)C1=C(O)C(=O)c2ccccc2C1=O |c:11,26| Show InChI InChI=1S/C28H18O8/c1-36-19-12-13(10-11-18(19)29)20(21-23(30)14-6-2-4-8-16(14)25(32)27(21)34)22-24(31)15-7-3-5-9-17(15)26(33)28(22)35/h2-12,20,29,34-35H,1H3	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.40E+4	n/a	n/a	n/a	n/a	7.5	n/a
Karunya University					Assay Description In simultaneous relaxation assay, CPT concentrations were 50 and 100 μM, whereas concentration of compounds were 50, 100 and 200 μM. Relaxation...				J Enzyme Inhib Med Chem 29: 185-9 (2014) Article DOI: 10.3109/14756366.2013.765413 BindingDB Entry DOI: 10.7270/Q2CJ8CDH
					More data for this Ligand-Target Pair