Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Oxysterols receptor LXR-alpha' and Ligand = 'BDBM50192152'   

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
Oxysterols receptor LXR-alpha (Homo sapiens (Human))	BDBM50192152 (2-(4-(2-((2-chloro-4-(1,1,1,3,3,3-hexafluoro-2-hyd...) Show SMILES CCN(C(COc1ccc(CC(O)=O)cc1)c1ccccc1)c1ccc(cc1Cl)C(O)(C(F)(F)F)C(F)(F)F Show InChI InChI=1S/C27H24ClF6NO4/c1-2-35(22-13-10-19(15-21(22)28)25(38,26(29,30)31)27(32,33)34)23(18-6-4-3-5-7-18)16-39-20-11-8-17(9-12-20)14-24(36)37/h3-13,15,23,38H,2,14,16H2,1H3,(H,36,37)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd. Curated by ChEMBL					Assay Description Binding affinity to LXRalpha by radioligand displacement assay				Bioorg Med Chem Lett 16: 5231-7 (2006) Article DOI: 10.1016/j.bmcl.2006.06.081 BindingDB Entry DOI: 10.7270/Q2HD7V80
					More data for this Ligand-Target Pair
Oxysterols receptor LXR-alpha (Homo sapiens (Human))	BDBM50192152 (2-(4-(2-((2-chloro-4-(1,1,1,3,3,3-hexafluoro-2-hyd...) Show SMILES CCN(C(COc1ccc(CC(O)=O)cc1)c1ccccc1)c1ccc(cc1Cl)C(O)(C(F)(F)F)C(F)(F)F Show InChI InChI=1S/C27H24ClF6NO4/c1-2-35(22-13-10-19(15-21(22)28)25(38,26(29,30)31)27(32,33)34)23(18-6-4-3-5-7-18)16-39-20-11-8-17(9-12-20)14-24(36)37/h3-13,15,23,38H,2,14,16H2,1H3,(H,36,37)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	5.50E+3	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd. Curated by ChEMBL					Assay Description Transactivation of LXRalpha by luciferase reporter gene assay				Bioorg Med Chem Lett 16: 5231-7 (2006) Article DOI: 10.1016/j.bmcl.2006.06.081 BindingDB Entry DOI: 10.7270/Q2HD7V80
					More data for this Ligand-Target Pair