BDBM50166301 (4-Methoxy-phenyl)-[2-methyl-3-(3-prop-2-ynyloxy-benzyl)-5-trifluoromethoxy-indol-1-yl]-methanone::CHEMBL372913

SMILES: COc1ccc(cc1)C(=O)n1c(C)c(Cc2cccc(OCC#C)c2)c2cc(OC(F)(F)F)ccc12

InChI Key: InChIKey=HEMWJRLDDQKGLA-UHFFFAOYSA-N

Data: 1 IC50  1 EC50

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 = 50166301   

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
Peroxisome proliferator-activated receptor (Homo sapiens (Human))	BDBM50166301 ((4-Methoxy-phenyl)-[2-methyl-3-(3-prop-2-ynyloxy-b...) Show SMILES COc1ccc(cc1)C(=O)n1c(C)c(Cc2cccc(OCC#C)c2)c2cc(OC(F)(F)F)ccc12 Show InChI InChI=1S/C28H22F3NO4/c1-4-14-35-22-7-5-6-19(15-22)16-24-18(2)32(27(33)20-8-10-21(34-3)11-9-20)26-13-12-23(17-25(24)26)36-28(29,30)31/h1,5-13,15,17H,14,16H2,2-3H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	31	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Maximal intrinsic response against peroxisome proliferator activated receptor gamma transactivation				Bioorg Med Chem Lett 15: 2437-40 (2005) Article DOI: 10.1016/j.bmcl.2005.03.092 BindingDB Entry DOI: 10.7270/Q2CF9PM8
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor (Homo sapiens (Human))	BDBM50166301 ((4-Methoxy-phenyl)-[2-methyl-3-(3-prop-2-ynyloxy-b...) Show SMILES COc1ccc(cc1)C(=O)n1c(C)c(Cc2cccc(OCC#C)c2)c2cc(OC(F)(F)F)ccc12 Show InChI InChI=1S/C28H22F3NO4/c1-4-14-35-22-7-5-6-19(15-22)16-24-18(2)32(27(33)20-8-10-21(34-3)11-9-20)26-13-12-23(17-25(24)26)36-28(29,30)31/h1,5-13,15,17H,14,16H2,2-3H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	62	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of human peroxisome proliferator activated receptor gamma binding				Bioorg Med Chem Lett 15: 2437-40 (2005) Article DOI: 10.1016/j.bmcl.2005.03.092 BindingDB Entry DOI: 10.7270/Q2CF9PM8
					More data for this Ligand-Target Pair