Compile Data Set for Download or QSAR

Found 5 hits Enz. Inhib. hit(s) with Target = 'DNA topoisomerase type IB small subunit'   

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
Topoisomerase I subunit B (Leishmania major)	BDBM50008923 ((S)-4-ethyl-4-hydroxy-1,12-dihydro-4H-2-oxa-6,12a-...) Show SMILES CC[C@@]1(O)C(=O)OCc2c1cc1-c3nc4ccccc4cc3Cn1c2=O |r| Show InChI InChI=1S/C20H16N2O4/c1-2-20(25)14-8-16-17-12(7-11-5-3-4-6-15(11)21-17)9-22(16)18(23)13(14)10-26-19(20)24/h3-8,25H,2,9-10H2,1H3/t20-/m0/s1	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	670	n/a	n/a	n/a	n/a
University of Puerto Rico Curated by ChEMBL					Assay Description Inhibition of Leishmania donovani topoisomerase 1B-mediated relaxation of supercoiled pSK DNA after 30 mins by ethidium bromide staining based agaros...				Bioorg Med Chem Lett 22: 6185-9 (2012) Article DOI: 10.1016/j.bmcl.2012.08.019 BindingDB Entry DOI: 10.7270/Q2R49RW0
					More data for this Ligand-Target Pair
Topoisomerase I subunit B (Leishmania major)	BDBM50392269 (CHEMBL2153502) Show SMILES CCCCCCCCCCCCCCCC#CC(O)=O Show InChI InChI=1S/C18H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h2-15H2,1H3,(H,19,20)	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	5.30E+3	n/a	n/a	n/a	n/a
University of Puerto Rico Curated by ChEMBL					Assay Description Inhibition of Leishmania donovani topoisomerase 1B-mediated relaxation of supercoiled pSK DNA after 30 mins by ethidium bromide staining based agaros...				Bioorg Med Chem Lett 22: 6185-9 (2012) Article DOI: 10.1016/j.bmcl.2012.08.019 BindingDB Entry DOI: 10.7270/Q2R49RW0
					More data for this Ligand-Target Pair
Topoisomerase I subunit B (Leishmania major)	BDBM50329257 (2-Hexadecynoic acid | CHEMBL1269411) Show SMILES CCCCCCCCCCCCCCC#CC(O)=O Show InChI InChI=1S/C17H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(18)19/h2-14H2,1H3,(H,18,19)	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	2.87E+4	n/a	n/a	n/a	n/a
University of Puerto Rico Curated by ChEMBL					Assay Description Inhibition of Leishmania donovani topoisomerase 1B-mediated relaxation of supercoiled pSK DNA after 30 mins by ethidium bromide staining based agaros...				Bioorg Med Chem Lett 22: 6185-9 (2012) Article DOI: 10.1016/j.bmcl.2012.08.019 BindingDB Entry DOI: 10.7270/Q2R49RW0
					More data for this Ligand-Target Pair
Topoisomerase I subunit B (Leishmania major)	BDBM50392268 (CHEMBL2153501) Show SMILES CCCCCCCCCCCC#CC(O)=O Show InChI InChI=1S/C14H24O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16/h2-11H2,1H3,(H,15,16)	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	6.78E+4	n/a	n/a	n/a	n/a
University of Puerto Rico Curated by ChEMBL					Assay Description Inhibition of Leishmania donovani topoisomerase 1B-mediated relaxation of supercoiled pSK DNA after 30 mins by ethidium bromide staining based agaros...				Bioorg Med Chem Lett 22: 6185-9 (2012) Article DOI: 10.1016/j.bmcl.2012.08.019 BindingDB Entry DOI: 10.7270/Q2R49RW0
					More data for this Ligand-Target Pair
DNA topoisomerase type IB small subunit (Leishmania donovani)	BDBM50239186 (1,1-Bis(3''-Indolyl)Methane | 3,3''-Diindolylmetha...) Show SMILES C(c1c[nH]c2ccccc12)c1c[nH]c2ccccc12 Show InChI InChI=1S/C17H14N2/c1-3-7-16-14(5-1)12(10-18-16)9-13-11-19-17-8-4-2-6-15(13)17/h1-8,10-11,18-19H,9H2	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	3.80E+5	n/a	n/a	n/a	n/a	n/a
India Institute of Chemical Biology Curated by ChEMBL					Assay Description Binding affinity to recombinant drug-resistant Leishmania donovani LdDR50 topoisomerase 1b small subunit N184S mutant after 24 hrs by equilibrium dia...				Antimicrob Agents Chemother 53: 2589-98 (2009) Article DOI: 10.1128/AAC.01648-08 BindingDB Entry DOI: 10.7270/Q2542RDS
					More data for this Ligand-Target Pair