Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 602.6 BDBM50508141

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 2 hits in this display   

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
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50508141 (CHEMBL4447577) Show SMILES CCOc1ccc(cc1CC(O)=O)-c1ccc(CCCc2nn(-c3ccc(cc3)C(F)(F)F)c(=O)n2-c2cccnc2)cc1 Show InChI InChI=1S/C33H29F3N4O4/c1-2-44-29-17-12-24(19-25(29)20-31(41)42)23-10-8-22(9-11-23)5-3-7-30-38-40(27-15-13-26(14-16-27)33(34,35)36)32(43)39(30)28-6-4-18-37-21-28/h4,6,8-19,21H,2-3,5,7,20H2,1H3,(H,41,42)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	61	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at recombinant human PPARdelta assessed as inhibition of GW0742-induced receptor activation after overnight incubation by cell-ba...				Bioorg Med Chem Lett 29: 503-508 (2019) Article DOI: 10.1016/j.bmcl.2018.12.045 BindingDB Entry DOI: 10.7270/Q2XK8JVQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50508141 (CHEMBL4447577) Show SMILES CCOc1ccc(cc1CC(O)=O)-c1ccc(CCCc2nn(-c3ccc(cc3)C(F)(F)F)c(=O)n2-c2cccnc2)cc1 Show InChI InChI=1S/C33H29F3N4O4/c1-2-44-29-17-12-24(19-25(29)20-31(41)42)23-10-8-22(9-11-23)5-3-7-30-38-40(27-15-13-26(14-16-27)33(34,35)36)32(43)39(30)28-6-4-18-37-21-28/h4,6,8-19,21H,2-3,5,7,20H2,1H3,(H,41,42)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	126	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at recombinant human PPARalpha assessed as inhibition of GW7647-induced receptor activation after overnight incubation by cell-ba...				Bioorg Med Chem Lett 29: 503-508 (2019) Article DOI: 10.1016/j.bmcl.2018.12.045 BindingDB Entry DOI: 10.7270/Q2XK8JVQ
					More data for this Ligand-Target Pair