Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Peroxisome proliferator-activated receptor alpha' and Ligand = 'BDBM50133663'   

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 alpha (Homo sapiens (Human))	BDBM50133663 (5-{3-[3-(4-Benzoyl-2-propyl-phenoxy)-propoxy]-phen...) Show SMILES CCCc1cc(ccc1OCCCOc1cccc(c1)-c1sc(=O)[nH]c1O)C(=O)c1ccccc1 Show InChI InChI=1S/C28H27NO5S/c1-2-8-20-17-21(25(30)19-9-4-3-5-10-19)13-14-24(20)34-16-7-15-33-23-12-6-11-22(18-23)26-27(31)29-28(32)35-26/h3-6,9-14,17-18,31H,2,7-8,15-16H2,1H3,(H,29,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	90.0	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional Aut£noma de M£xico Curated by ChEMBL					Assay Description Agonist activity at PPARalpha				Bioorg Med Chem 20: 3523-32 (2012) Article DOI: 10.1016/j.bmc.2012.04.005 BindingDB Entry DOI: 10.7270/Q2MP54B4
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50133663 (5-{3-[3-(4-Benzoyl-2-propyl-phenoxy)-propoxy]-phen...) Show SMILES CCCc1cc(ccc1OCCCOc1cccc(c1)-c1sc(=O)[nH]c1O)C(=O)c1ccccc1 Show InChI InChI=1S/C28H27NO5S/c1-2-8-20-17-21(25(30)19-9-4-3-5-10-19)13-14-24(20)34-16-7-15-33-23-12-6-11-22(18-23)26-27(31)29-28(32)35-26/h3-6,9-14,17-18,31H,2,7-8,15-16H2,1H3,(H,29,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	90	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description In vitro binding affinity was tested towards human Peroxisome proliferator activated receptor alpha				Bioorg Med Chem Lett 13: 3541-4 (2003) BindingDB Entry DOI: 10.7270/Q2NZ871J
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50133663 (5-{3-[3-(4-Benzoyl-2-propyl-phenoxy)-propoxy]-phen...) Show SMILES CCCc1cc(ccc1OCCCOc1cccc(c1)-c1sc(=O)[nH]c1O)C(=O)c1ccccc1 Show InChI InChI=1S/C28H27NO5S/c1-2-8-20-17-21(25(30)19-9-4-3-5-10-19)13-14-24(20)34-16-7-15-33-23-12-6-11-22(18-23)26-27(31)29-28(32)35-26/h3-6,9-14,17-18,31H,2,7-8,15-16H2,1H3,(H,29,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	>3.00E+3	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description In vitro activity in human Peroxisome proliferator activated receptor alpha-transactivation assay				Bioorg Med Chem Lett 13: 3541-4 (2003) BindingDB Entry DOI: 10.7270/Q2NZ871J
					More data for this Ligand-Target Pair