Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Peroxisome proliferator-activated receptor gamma' and Ligand = 'BDBM50133669'   

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 gamma (Homo sapiens (Human))	BDBM50133669 (5-{3-[3-(4-Cycloheptyloxy-2-propyl-phenoxy)-propox...) Show SMILES CCCc1cc(OC2CCCCCC2)ccc1OCCCOc1cccc(c1)-c1sc(=O)[nH]c1O Show InChI InChI=1S/C28H35NO5S/c1-2-9-20-18-24(34-22-11-5-3-4-6-12-22)14-15-25(20)33-17-8-16-32-23-13-7-10-21(19-23)26-27(30)29-28(31)35-26/h7,10,13-15,18-19,22,30H,2-6,8-9,11-12,16-17H2,1H3,(H,29,31)	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	85	n/a	n/a	n/a	n/a	n/a	n/a
Universiti Sains Malaysia Curated by ChEMBL					Assay Description Displacement of radio-labeled full agonist from PPARgamma receptor				Eur J Med Chem 46: 2513-29 (2011) Article DOI: 10.1016/j.ejmech.2011.03.040 BindingDB Entry DOI: 10.7270/Q2K35V05
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50133669 (5-{3-[3-(4-Cycloheptyloxy-2-propyl-phenoxy)-propox...) Show SMILES CCCc1cc(OC2CCCCCC2)ccc1OCCCOc1cccc(c1)-c1sc(=O)[nH]c1O Show InChI InChI=1S/C28H35NO5S/c1-2-9-20-18-24(34-22-11-5-3-4-6-12-22)14-15-25(20)33-17-8-16-32-23-13-7-10-21(19-23)26-27(30)29-28(31)35-26/h7,10,13-15,18-19,22,30H,2-6,8-9,11-12,16-17H2,1H3,(H,29,31)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	85	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description In vitro binding affinity against human peroxisome proliferator activated receptor gamma				Bioorg Med Chem Lett 13: 3541-4 (2003) BindingDB Entry DOI: 10.7270/Q2NZ871J
					More data for this Ligand-Target Pair