Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Peroxisome proliferator-activated receptor delta' and Ligand = 'BDBM50133661'   

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))	BDBM50133661 (5-{3-[3-(4-Benzo[d]isoxazol-3-yl-2-propyl-phenoxy)...) Show SMILES CCCc1cc(ccc1OCCCOc1cccc(c1)-c1sc(=O)[nH]c1O)-c1noc2ccccc12 Show InChI InChI=1S/C28H26N2O5S/c1-2-7-18-16-19(25-22-10-3-4-11-24(22)35-30-25)12-13-23(18)34-15-6-14-33-21-9-5-8-20(17-21)26-27(31)29-28(32)36-26/h3-5,8-13,16-17,31H,2,6-7,14-15H2,1H3,(H,29,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	140	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 PPARdelta				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 delta (Homo sapiens (Human))	BDBM50133661 (5-{3-[3-(4-Benzo[d]isoxazol-3-yl-2-propyl-phenoxy)...) Show SMILES CCCc1cc(ccc1OCCCOc1cccc(c1)-c1sc(=O)[nH]c1O)-c1noc2ccccc12 Show InChI InChI=1S/C28H26N2O5S/c1-2-7-18-16-19(25-22-10-3-4-11-24(22)35-30-25)12-13-23(18)34-15-6-14-33-21-9-5-8-20(17-21)26-27(31)29-28(32)36-26/h3-5,8-13,16-17,31H,2,6-7,14-15H2,1H3,(H,29,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	140	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 delta				Bioorg Med Chem Lett 13: 3541-4 (2003) BindingDB Entry DOI: 10.7270/Q2NZ871J
					More data for this Ligand-Target Pair