Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Integrase' and Ligand = 'BDBM50483532'   

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
Integrase (Human immunodeficiency virus 1)	BDBM50483532 (CHEMBL1682068) Show SMILES OC(=O)c1cc(Br)cc(C(=O)NCc2ccc(F)cc2)c1O Show InChI InChI=1S/C15H11BrFNO4/c16-9-5-11(13(19)12(6-9)15(21)22)14(20)18-7-8-1-3-10(17)4-2-8/h1-6,19H,7H2,(H,18,20)(H,21,22)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Tennessee Health Science Center Curated by ChEMBL					Assay Description Inhibition of Human immunodeficiency virus 1 integrase strand transfer activity after 30 mins by polyacrylamide gel electrophoresis				Bioorg Med Chem 19: 2030-45 (2011) Article DOI: 10.1016/j.bmc.2011.01.047 BindingDB Entry DOI: 10.7270/Q2DN47WZ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50483532 (CHEMBL1682068) Show SMILES OC(=O)c1cc(Br)cc(C(=O)NCc2ccc(F)cc2)c1O Show InChI InChI=1S/C15H11BrFNO4/c16-9-5-11(13(19)12(6-9)15(21)22)14(20)18-7-8-1-3-10(17)4-2-8/h1-6,19H,7H2,(H,18,20)(H,21,22)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.51E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Tennessee Health Science Center Curated by ChEMBL					Assay Description Inhibition of Human immunodeficiency virus 1 integrase strand transfer activity after 30 mins by polyacrylamide gel electrophoresis				Bioorg Med Chem 19: 2030-45 (2011) Article DOI: 10.1016/j.bmc.2011.01.047 BindingDB Entry DOI: 10.7270/Q2DN47WZ
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50483532 (CHEMBL1682068) Show SMILES OC(=O)c1cc(Br)cc(C(=O)NCc2ccc(F)cc2)c1O Show InChI InChI=1S/C15H11BrFNO4/c16-9-5-11(13(19)12(6-9)15(21)22)14(20)18-7-8-1-3-10(17)4-2-8/h1-6,19H,7H2,(H,18,20)(H,21,22)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Tennessee Health Science Center Curated by ChEMBL					Assay Description Inhibition of Human immunodeficiency virus 1 integrase-mediated 3'-processing after 30 mins by polyacrylamide gel electrophoresis				Bioorg Med Chem 19: 2030-45 (2011) Article DOI: 10.1016/j.bmc.2011.01.047 BindingDB Entry DOI: 10.7270/Q2DN47WZ
					More data for this Ligand-Target Pair