Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Integrase' and Ligand = 'BDBM50485913'   

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)	BDBM50485913 (CHEMBL2180586) Show SMILES CS(=O)(=O)NCCCCCCN(c1nc(C(=O)NCc2ccc(F)cc2)c(O)c2ncccc12)S(C)(=O)=O Show InChI InChI=1S/C24H30FN5O6S2/c1-37(33,34)28-14-5-3-4-6-15-30(38(2,35)36)23-19-8-7-13-26-20(19)22(31)21(29-23)24(32)27-16-17-9-11-18(25)12-10-17/h7-13,28,31H,3-6,14-16H2,1-2H3,(H,27,32)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	700	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity using [32P]-labeled linear oligonucleotide substrate				J Med Chem 55: 9492-509 (2012) Article DOI: 10.1021/jm300667v BindingDB Entry DOI: 10.7270/Q2KS6VF8
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50485913 (CHEMBL2180586) Show SMILES CS(=O)(=O)NCCCCCCN(c1nc(C(=O)NCc2ccc(F)cc2)c(O)c2ncccc12)S(C)(=O)=O Show InChI InChI=1S/C24H30FN5O6S2/c1-37(33,34)28-14-5-3-4-6-15-30(38(2,35)36)23-19-8-7-13-26-20(19)22(31)21(29-23)24(32)27-16-17-9-11-18(25)12-10-17/h7-13,28,31H,3-6,14-16H2,1-2H3,(H,27,32)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase 3'-processing activity using [32P]-labeled linear oligonucleotide substrate				J Med Chem 55: 9492-509 (2012) Article DOI: 10.1021/jm300667v BindingDB Entry DOI: 10.7270/Q2KS6VF8
					More data for this Ligand-Target Pair