Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Integrase' and Ligand = 'BDBM50499579'   

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)	BDBM50499579 (CHEMBL3740311) Show SMILES COc1ccc(cc1)C1=Cc2ccc(cc2C(CC(C)=O)N1c1ccc(cc1)C#N)[N+]([O-])=O |t:9| Show InChI InChI=1S/C26H21N3O4/c1-17(30)13-26-24-15-22(29(31)32)10-5-20(24)14-25(19-6-11-23(33-2)12-7-19)28(26)21-8-3-18(16-27)4-9-21/h3-12,14-15,26H,13H2,1-2H3	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Delhi Curated by ChEMBL					Assay Description Inhibition of HIV-1 integrase G140S mutant strand transfer activity preincubated for 30 mins followed by addition of FITC-labelled dsDNA for 1 hr by ...				ACS Med Chem Lett 6: 1065-70 (2015) Article DOI: 10.1021/acsmedchemlett.5b00230 BindingDB Entry DOI: 10.7270/Q2348PDM
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50499579 (CHEMBL3740311) Show SMILES COc1ccc(cc1)C1=Cc2ccc(cc2C(CC(C)=O)N1c1ccc(cc1)C#N)[N+]([O-])=O |t:9| Show InChI InChI=1S/C26H21N3O4/c1-17(30)13-26-24-15-22(29(31)32)10-5-20(24)14-25(19-6-11-23(33-2)12-7-19)28(26)21-8-3-18(16-27)4-9-21/h3-12,14-15,26H,13H2,1-2H3	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Delhi Curated by ChEMBL					Assay Description Inhibition of HIV-1 integrase strand transfer activity preincubated for 30 mins followed by addition of FITC-labelled dsDNA for 1 hr by microplate re...				ACS Med Chem Lett 6: 1065-70 (2015) Article DOI: 10.1021/acsmedchemlett.5b00230 BindingDB Entry DOI: 10.7270/Q2348PDM
					More data for this Ligand-Target Pair