Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Integrase' and Ligand = 'BDBM50482541'   

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)	BDBM50482541 (CHEMBL1214536) Show SMILES CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)c(Cl)c2)c2cccc(OC)c12 Show InChI InChI=1S/C22H19ClFNO5/c1-3-30-22(28)19(27)10-18(26)14-12-25(11-13-7-8-16(24)15(23)9-13)17-5-4-6-20(29-2)21(14)17/h4-10,12,27H,3,11H2,1-2H3/b19-10-	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	70	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Messina Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer				Bioorg Med Chem 18: 5510-8 (2010) Article DOI: 10.1016/j.bmc.2010.06.063 BindingDB Entry DOI: 10.7270/Q2Z322G6
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50482541 (CHEMBL1214536) Show SMILES CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)c(Cl)c2)c2cccc(OC)c12 Show InChI InChI=1S/C22H19ClFNO5/c1-3-30-22(28)19(27)10-18(26)14-12-25(11-13-7-8-16(24)15(23)9-13)17-5-4-6-20(29-2)21(14)17/h4-10,12,27H,3,11H2,1-2H3/b19-10-	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	360	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Messina Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase				Bioorg Med Chem 18: 5510-8 (2010) Article DOI: 10.1016/j.bmc.2010.06.063 BindingDB Entry DOI: 10.7270/Q2Z322G6
					More data for this Ligand-Target Pair