BDBM50227150 2-(4-((3-(3-benzoyl-8-(trifluoromethyl)quinolin-5-yl)phenoxy)methyl)phenyl)-3-(4-tert-butylphenyl)propanoic acid::CHEMBL253730

SMILES: CC(C)(C)c1ccc(CC(C(O)=O)c2ccc(COc3cccc(c3)-c3ccc(c4ncc(cc34)C(=O)c3ccccc3)C(F)(F)F)cc2)cc1

InChI Key: InChIKey=PGKSRZMWYJNXAT-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50227150   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/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))	BDBM50227150 (2-(4-((3-(3-benzoyl-8-(trifluoromethyl)quinolin-5-...) Show SMILES CC(C)(C)c1ccc(CC(C(O)=O)c2ccc(COc3cccc(c3)-c3ccc(c4ncc(cc34)C(=O)c3ccccc3)C(F)(F)F)cc2)cc1 |w:9.8| Show InChI InChI=1S/C43H36F3NO4/c1-42(2,3)33-18-14-27(15-19-33)22-36(41(49)50)29-16-12-28(13-17-29)26-51-34-11-7-10-31(23-34)35-20-21-38(43(44,45)46)39-37(35)24-32(25-47-39)40(48)30-8-5-4-6-9-30/h4-21,23-25,36H,22,26H2,1-3H3,(H,49,50)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	65	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Pharmaceuticals Curated by ChEMBL					Assay Description Binding affinity at human LXRalpha				Bioorg Med Chem Lett 18: 54-9 (2008) Article DOI: 10.1016/j.bmcl.2007.11.013 BindingDB Entry DOI: 10.7270/Q2N879JT
					More data for this Ligand-Target Pair
Oxysterols receptor LXR-beta (Homo sapiens (Human))	BDBM50227150 (2-(4-((3-(3-benzoyl-8-(trifluoromethyl)quinolin-5-...) Show SMILES CC(C)(C)c1ccc(CC(C(O)=O)c2ccc(COc3cccc(c3)-c3ccc(c4ncc(cc34)C(=O)c3ccccc3)C(F)(F)F)cc2)cc1 |w:9.8| Show InChI InChI=1S/C43H36F3NO4/c1-42(2,3)33-18-14-27(15-19-33)22-36(41(49)50)29-16-12-28(13-17-29)26-51-34-11-7-10-31(23-34)35-20-21-38(43(44,45)46)39-37(35)24-32(25-47-39)40(48)30-8-5-4-6-9-30/h4-21,23-25,36H,22,26H2,1-3H3,(H,49,50)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	81	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Pharmaceuticals Curated by ChEMBL					Assay Description Binding affinity at human LXRbeta				Bioorg Med Chem Lett 18: 54-9 (2008) Article DOI: 10.1016/j.bmcl.2007.11.013 BindingDB Entry DOI: 10.7270/Q2N879JT
					More data for this Ligand-Target Pair