Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Integrase' and Ligand = 'BDBM50170913'   

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)	BDBM50170913 (CHEMBL3805999) Show SMILES ON1C(=O)C(C(=O)NC2CCCC2)c2ccccc2C1=O Show InChI InChI=1S/C15H16N2O4/c18-13(16-9-5-1-2-6-9)12-10-7-3-4-8-11(10)14(19)17(21)15(12)20/h3-4,7-9,12,21H,1-2,5-6H2,(H,16,18)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.36E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Lille Nord de France Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase using 3'-biotin-labelled and 5'-digoxigenin-labelled oligonucleotide substrate incubated for 1 hr by ELISA				Eur J Med Chem 117: 256-68 (2016) Article DOI: 10.1016/j.ejmech.2016.03.083 BindingDB Entry DOI: 10.7270/Q22V2J1P
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50170913 (CHEMBL3805999) Show SMILES ON1C(=O)C(C(=O)NC2CCCC2)c2ccccc2C1=O Show InChI InChI=1S/C15H16N2O4/c18-13(16-9-5-1-2-6-9)12-10-7-3-4-8-11(10)14(19)17(21)15(12)20/h3-4,7-9,12,21H,1-2,5-6H2,(H,16,18)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.63E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Lille Nord de France Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity using 5'[digoxigenin]-GACCCTTTTAGTCAGTGTGGAAAATCTCTAGCA-3' as substrate incubated for 1 hr by E...				Eur J Med Chem 117: 256-68 (2016) Article DOI: 10.1016/j.ejmech.2016.03.083 BindingDB Entry DOI: 10.7270/Q22V2J1P
					More data for this Ligand-Target Pair