Compile Data Set for Download or QSAR

Found 32 hits Enz. Inhib. hit(s) with all data for entry = 50016041   

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))	BDBM50164212 (2-(5,7-Dipropyl-3-trifluoromethyl-benzo[d]isoxazol...) Show SMILES CCCc1cc2c(noc2c(CCC)c1OC(C)(CC)C(O)=O)C(F)(F)F Show InChI InChI=1S/C19H24F3NO4/c1-5-8-11-10-13-15(27-23-16(13)19(20,21)22)12(9-6-2)14(11)26-18(4,7-3)17(24)25/h10H,5-9H2,1-4H3,(H,24,25)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	100	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 alpha binding				J Med Chem 48: 2262-5 (2005) Article DOI: 10.1021/jm048993p BindingDB Entry DOI: 10.7270/Q2VT1RM6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50164210 (2-(5,7-Dipropyl-3-trifluoromethyl-benzo[d]isoxazol...) Show SMILES CCCc1cc2c(noc2c(CCC)c1OC(C)(C)C(O)=O)C(F)(F)F Show InChI InChI=1S/C18H22F3NO4/c1-5-7-10-9-12-14(26-22-15(12)18(19,20)21)11(8-6-2)13(10)25-17(3,4)16(23)24/h9H,5-8H2,1-4H3,(H,23,24)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	230	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 alpha binding				J Med Chem 48: 2262-5 (2005) Article DOI: 10.1021/jm048993p BindingDB Entry DOI: 10.7270/Q2VT1RM6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM28681 (5-[(4-{2-[methyl(pyridin-2-yl)amino]ethoxy}phenyl)...) Show SMILES CN(CCOc1ccc(Cc2sc(=O)[nH]c2O)cc1)c1ccccn1 Show InChI InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,22H,10-12H2,1H3,(H,20,23)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	250	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				J Med Chem 48: 2262-5 (2005) Article DOI: 10.1021/jm048993p BindingDB Entry DOI: 10.7270/Q2VT1RM6
					More data for this Ligand-Target Pair				3D Structure (crystal)
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50164213 (2-Methyl-2-(4-propionyl-2,6-dipropyl-phenoxy)-prop...) Show SMILES CCCc1cc(cc(CCC)c1OC(C)(C)C(O)=O)C(=O)CC Show InChI InChI=1S/C19H28O4/c1-6-9-13-11-15(16(20)8-3)12-14(10-7-2)17(13)23-19(4,5)18(21)22/h11-12H,6-10H2,1-5H3,(H,21,22)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	480	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 alpha binding				J Med Chem 48: 2262-5 (2005) Article DOI: 10.1021/jm048993p BindingDB Entry DOI: 10.7270/Q2VT1RM6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50164214 (2-(5,7-Dipropyl-3-trifluoromethyl-benzo[d]isoxazol...) Show SMILES CCCc1cc2c(noc2c(CCC)c1OC(C)C(O)=O)C(F)(F)F Show InChI InChI=1S/C17H20F3NO4/c1-4-6-10-8-12-14(25-21-15(12)17(18,19)20)11(7-5-2)13(10)24-9(3)16(22)23/h8-9H,4-7H2,1-3H3,(H,22,23)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.03E+3	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 alpha binding				J Med Chem 48: 2262-5 (2005) Article DOI: 10.1021/jm048993p BindingDB Entry DOI: 10.7270/Q2VT1RM6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50164213 (2-Methyl-2-(4-propionyl-2,6-dipropyl-phenoxy)-prop...) Show SMILES CCCc1cc(cc(CCC)c1OC(C)(C)C(O)=O)C(=O)CC Show InChI InChI=1S/C19H28O4/c1-6-9-13-11-15(16(20)8-3)12-14(10-7-2)17(13)23-19(4,5)18(21)22/h11-12H,6-10H2,1-5H3,(H,21,22)	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	1.22E+3	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				J Med Chem 48: 2262-5 (2005) Article DOI: 10.1021/jm048993p BindingDB Entry DOI: 10.7270/Q2VT1RM6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50164208 (2-(3-Methoxy-5,7-dipropyl-benzo[d]isoxazol-6-yloxy...) Show SMILES CCCc1cc2c(OC)noc2c(CCC)c1OC(C)(C)C(O)=O Show InChI InChI=1S/C18H25NO5/c1-6-8-11-10-13-15(24-19-16(13)22-5)12(9-7-2)14(11)23-18(3,4)17(20)21/h10H,6-9H2,1-5H3,(H,20,21)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.51E+3	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 alpha binding				J Med Chem 48: 2262-5 (2005) Article DOI: 10.1021/jm048993p BindingDB Entry DOI: 10.7270/Q2VT1RM6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50164210 (2-(5,7-Dipropyl-3-trifluoromethyl-benzo[d]isoxazol...) Show SMILES CCCc1cc2c(noc2c(CCC)c1OC(C)(C)C(O)=O)C(F)(F)F Show InChI InChI=1S/C18H22F3NO4/c1-5-7-10-9-12-14(26-22-15(12)18(19,20)21)11(8-6-2)13(10)25-17(3,4)16(23)24/h9H,5-8H2,1-4H3,(H,23,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.58E+3	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				J Med Chem 48: 2262-5 (2005) Article DOI: 10.1021/jm048993p BindingDB Entry DOI: 10.7270/Q2VT1RM6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50164208 (2-(3-Methoxy-5,7-dipropyl-benzo[d]isoxazol-6-yloxy...) Show SMILES CCCc1cc2c(OC)noc2c(CCC)c1OC(C)(C)C(O)=O Show InChI InChI=1S/C18H25NO5/c1-6-8-11-10-13-15(24-19-16(13)22-5)12(9-7-2)14(11)23-18(3,4)17(20)21/h10H,6-9H2,1-5H3,(H,20,21)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.62E+3	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				J Med Chem 48: 2262-5 (2005) Article DOI: 10.1021/jm048993p BindingDB Entry DOI: 10.7270/Q2VT1RM6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50164214 (2-(5,7-Dipropyl-3-trifluoromethyl-benzo[d]isoxazol...) Show SMILES CCCc1cc2c(noc2c(CCC)c1OC(C)C(O)=O)C(F)(F)F Show InChI InChI=1S/C17H20F3NO4/c1-4-6-10-8-12-14(25-21-15(12)17(18,19)20)11(7-5-2)13(10)24-9(3)16(22)23/h8-9H,4-7H2,1-3H3,(H,22,23)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>1.00E+4	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				J Med Chem 48: 2262-5 (2005) Article DOI: 10.1021/jm048993p BindingDB Entry DOI: 10.7270/Q2VT1RM6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50164211 (2-Methyl-2-(7-propyl-3-trifluoromethyl-benzo[d]iso...) Show SMILES CCCc1c(OC(C)(C)C(O)=O)ccc2c(noc12)C(F)(F)F Show InChI InChI=1S/C15H16F3NO4/c1-4-5-8-10(22-14(2,3)13(20)21)7-6-9-11(8)23-19-12(9)15(16,17)18/h6-7H,4-5H2,1-3H3,(H,20,21)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	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 alpha binding				J Med Chem 48: 2262-5 (2005) Article DOI: 10.1021/jm048993p BindingDB Entry DOI: 10.7270/Q2VT1RM6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50164211 (2-Methyl-2-(7-propyl-3-trifluoromethyl-benzo[d]iso...) Show SMILES CCCc1c(OC(C)(C)C(O)=O)ccc2c(noc12)C(F)(F)F Show InChI InChI=1S/C15H16F3NO4/c1-4-5-8-10(22-14(2,3)13(20)21)7-6-9-11(8)23-19-12(9)15(16,17)18/h6-7H,4-5H2,1-3H3,(H,20,21)	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	>1.00E+4	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				J Med Chem 48: 2262-5 (2005) Article DOI: 10.1021/jm048993p BindingDB Entry DOI: 10.7270/Q2VT1RM6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50164212 (2-(5,7-Dipropyl-3-trifluoromethyl-benzo[d]isoxazol...) Show SMILES CCCc1cc2c(noc2c(CCC)c1OC(C)(CC)C(O)=O)C(F)(F)F Show InChI InChI=1S/C19H24F3NO4/c1-5-8-11-10-13-15(27-23-16(13)19(20,21)22)12(9-6-2)14(11)26-18(4,7-3)17(24)25/h10H,5-9H2,1-4H3,(H,24,25)	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	>1.50E+4	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				J Med Chem 48: 2262-5 (2005) Article DOI: 10.1021/jm048993p BindingDB Entry DOI: 10.7270/Q2VT1RM6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50164209 (3-(5,7-Dipropyl-3-trifluoromethyl-benzo[d]isoxazol...) Show SMILES CCCc1cc2c(noc2c(CCC)c1OCC(C)(C)C(O)=O)C(F)(F)F Show InChI InChI=1S/C19H24F3NO4/c1-5-7-11-9-13-15(27-23-16(13)19(20,21)22)12(8-6-2)14(11)26-10-18(3,4)17(24)25/h9H,5-8,10H2,1-4H3,(H,24,25)	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	>1.50E+4	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				J Med Chem 48: 2262-5 (2005) Article DOI: 10.1021/jm048993p BindingDB Entry DOI: 10.7270/Q2VT1RM6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM28700 (2-(4-(4-Chlorobenzoyl)phenoxy)-2-methylpropionic a...) Show SMILES CC(C)(Oc1ccc(cc1)C(=O)c1ccc(Cl)cc1)C(O)=O Show InChI InChI=1S/C17H15ClO4/c1-17(2,16(20)21)22-14-9-5-12(6-10-14)15(19)11-3-7-13(18)8-4-11/h3-10H,1-2H3,(H,20,21)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	3.50E+4	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 alpha binding				J Med Chem 48: 2262-5 (2005) Article DOI: 10.1021/jm048993p BindingDB Entry DOI: 10.7270/Q2VT1RM6
					More data for this Ligand-Target Pair				3D Structure (crystal)
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50164209 (3-(5,7-Dipropyl-3-trifluoromethyl-benzo[d]isoxazol...) Show SMILES CCCc1cc2c(noc2c(CCC)c1OCC(C)(C)C(O)=O)C(F)(F)F Show InChI InChI=1S/C19H24F3NO4/c1-5-7-11-9-13-15(27-23-16(13)19(20,21)22)12(8-6-2)14(11)26-10-18(3,4)17(24)25/h9H,5-8,10H2,1-4H3,(H,24,25)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+4	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 alpha binding				J Med Chem 48: 2262-5 (2005) Article DOI: 10.1021/jm048993p BindingDB Entry DOI: 10.7270/Q2VT1RM6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM28700 (2-(4-(4-Chlorobenzoyl)phenoxy)-2-methylpropionic a...) Show SMILES CC(C)(Oc1ccc(cc1)C(=O)c1ccc(Cl)cc1)C(O)=O Show InChI InChI=1S/C17H15ClO4/c1-17(2,16(20)21)22-14-9-5-12(6-10-14)15(19)11-3-7-13(18)8-4-11/h3-10H,1-2H3,(H,20,21)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	>5.00E+4	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				J Med Chem 48: 2262-5 (2005) Article DOI: 10.1021/jm048993p BindingDB Entry DOI: 10.7270/Q2VT1RM6
					More data for this Ligand-Target Pair				3D Structure (crystal)
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM28681 (5-[(4-{2-[methyl(pyridin-2-yl)amino]ethoxy}phenyl)...) Show SMILES CN(CCOc1ccc(Cc2sc(=O)[nH]c2O)cc1)c1ccccn1 Show InChI InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,22H,10-12H2,1H3,(H,20,23)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	>5.00E+4	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 alpha binding				J Med Chem 48: 2262-5 (2005) Article DOI: 10.1021/jm048993p BindingDB Entry DOI: 10.7270/Q2VT1RM6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50164210 (2-(5,7-Dipropyl-3-trifluoromethyl-benzo[d]isoxazol...) Show SMILES CCCc1cc2c(noc2c(CCC)c1OC(C)(C)C(O)=O)C(F)(F)F Show InChI InChI=1S/C18H22F3NO4/c1-5-7-10-9-12-14(26-22-15(12)18(19,20)21)11(8-6-2)13(10)25-17(3,4)16(23)24/h9H,5-8H2,1-4H3,(H,23,24)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	300	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Effective concentration against human Peroxisome proliferator activated receptor alpha in Gal4 transactivation assay				J Med Chem 48: 2262-5 (2005) Article DOI: 10.1021/jm048993p BindingDB Entry DOI: 10.7270/Q2VT1RM6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50164214 (2-(5,7-Dipropyl-3-trifluoromethyl-benzo[d]isoxazol...) Show SMILES CCCc1cc2c(noc2c(CCC)c1OC(C)C(O)=O)C(F)(F)F Show InChI InChI=1S/C17H20F3NO4/c1-4-6-10-8-12-14(25-21-15(12)17(18,19)20)11(7-5-2)13(10)24-9(3)16(22)23/h8-9H,4-7H2,1-3H3,(H,22,23)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	620	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Effective concentration against human Peroxisome proliferator activated receptor alpha in Gal4 transactivation assay				J Med Chem 48: 2262-5 (2005) Article DOI: 10.1021/jm048993p BindingDB Entry DOI: 10.7270/Q2VT1RM6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50164212 (2-(5,7-Dipropyl-3-trifluoromethyl-benzo[d]isoxazol...) Show SMILES CCCc1cc2c(noc2c(CCC)c1OC(C)(CC)C(O)=O)C(F)(F)F Show InChI InChI=1S/C19H24F3NO4/c1-5-8-11-10-13-15(27-23-16(13)19(20,21)22)12(9-6-2)14(11)26-18(4,7-3)17(24)25/h10H,5-9H2,1-4H3,(H,24,25)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	750	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Effective concentration against human Peroxisome proliferator activated receptor alpha in Gal4 transactivation assay				J Med Chem 48: 2262-5 (2005) Article DOI: 10.1021/jm048993p BindingDB Entry DOI: 10.7270/Q2VT1RM6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM28681 (5-[(4-{2-[methyl(pyridin-2-yl)amino]ethoxy}phenyl)...) Show SMILES CN(CCOc1ccc(Cc2sc(=O)[nH]c2O)cc1)c1ccccn1 Show InChI InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,22H,10-12H2,1H3,(H,20,23)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Effective concentration against human Peroxisome proliferator activated receptor alpha in Gal4 transactivation assay				J Med Chem 48: 2262-5 (2005) Article DOI: 10.1021/jm048993p BindingDB Entry DOI: 10.7270/Q2VT1RM6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Canis familiaris)	BDBM50164210 (2-(5,7-Dipropyl-3-trifluoromethyl-benzo[d]isoxazol...) Show SMILES CCCc1cc2c(noc2c(CCC)c1OC(C)(C)C(O)=O)C(F)(F)F Show InChI InChI=1S/C18H22F3NO4/c1-5-7-10-9-12-14(26-22-15(12)18(19,20)21)11(8-6-2)13(10)25-17(3,4)16(23)24/h9H,5-8H2,1-4H3,(H,23,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	550	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Agonist activity against dog Peroxisome proliferator activated receptor alpha				J Med Chem 48: 2262-5 (2005) Article DOI: 10.1021/jm048993p BindingDB Entry DOI: 10.7270/Q2VT1RM6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM28700 (2-(4-(4-Chlorobenzoyl)phenoxy)-2-methylpropionic a...) Show SMILES CC(C)(Oc1ccc(cc1)C(=O)c1ccc(Cl)cc1)C(O)=O Show InChI InChI=1S/C17H15ClO4/c1-17(2,16(20)21)22-14-9-5-12(6-10-14)15(19)11-3-7-13(18)8-4-11/h3-10H,1-2H3,(H,20,21)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Effective concentration against human Peroxisome proliferator activated receptor gamma in Gal4 transactivation assay				J Med Chem 48: 2262-5 (2005) Article DOI: 10.1021/jm048993p BindingDB Entry DOI: 10.7270/Q2VT1RM6
					More data for this Ligand-Target Pair				3D Structure (crystal)
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50164213 (2-Methyl-2-(4-propionyl-2,6-dipropyl-phenoxy)-prop...) Show SMILES CCCc1cc(cc(CCC)c1OC(C)(C)C(O)=O)C(=O)CC Show InChI InChI=1S/C19H28O4/c1-6-9-13-11-15(16(20)8-3)12-14(10-7-2)17(13)23-19(4,5)18(21)22/h11-12H,6-10H2,1-5H3,(H,21,22)	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	1.30E+3	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Effective concentration against human Peroxisome proliferator activated receptor gamma in Gal4 transactivation assay				J Med Chem 48: 2262-5 (2005) Article DOI: 10.1021/jm048993p BindingDB Entry DOI: 10.7270/Q2VT1RM6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50164210 (2-(5,7-Dipropyl-3-trifluoromethyl-benzo[d]isoxazol...) Show SMILES CCCc1cc2c(noc2c(CCC)c1OC(C)(C)C(O)=O)C(F)(F)F Show InChI InChI=1S/C18H22F3NO4/c1-5-7-10-9-12-14(26-22-15(12)18(19,20)21)11(8-6-2)13(10)25-17(3,4)16(23)24/h9H,5-8H2,1-4H3,(H,23,24)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	460	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Agonist activity against hamster Peroxisome proliferator activated receptor alpha				J Med Chem 48: 2262-5 (2005) Article DOI: 10.1021/jm048993p BindingDB Entry DOI: 10.7270/Q2VT1RM6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM28681 (5-[(4-{2-[methyl(pyridin-2-yl)amino]ethoxy}phenyl)...) Show SMILES CN(CCOc1ccc(Cc2sc(=O)[nH]c2O)cc1)c1ccccn1 Show InChI InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,22H,10-12H2,1H3,(H,20,23)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	n/a	n/a	20	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Effective concentration against human Peroxisome proliferator activated receptor gamma in Gal4 transactivation assay				J Med Chem 48: 2262-5 (2005) Article DOI: 10.1021/jm048993p BindingDB Entry DOI: 10.7270/Q2VT1RM6
					More data for this Ligand-Target Pair				3D Structure (crystal)
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50164213 (2-Methyl-2-(4-propionyl-2,6-dipropyl-phenoxy)-prop...) Show SMILES CCCc1cc(cc(CCC)c1OC(C)(C)C(O)=O)C(=O)CC Show InChI InChI=1S/C19H28O4/c1-6-9-13-11-15(16(20)8-3)12-14(10-7-2)17(13)23-19(4,5)18(21)22/h11-12H,6-10H2,1-5H3,(H,21,22)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	10	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Effective concentration against human Peroxisome proliferator activated receptor alpha in Gal4 transactivation assay				J Med Chem 48: 2262-5 (2005) Article DOI: 10.1021/jm048993p BindingDB Entry DOI: 10.7270/Q2VT1RM6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM28700 (2-(4-(4-Chlorobenzoyl)phenoxy)-2-methylpropionic a...) Show SMILES CC(C)(Oc1ccc(cc1)C(=O)c1ccc(Cl)cc1)C(O)=O Show InChI InChI=1S/C17H15ClO4/c1-17(2,16(20)21)22-14-9-5-12(6-10-14)15(19)11-3-7-13(18)8-4-11/h3-10H,1-2H3,(H,20,21)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	n/a	n/a	1.50E+4	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Effective concentration against human Peroxisome proliferator activated receptor alpha in Gal4 transactivation assay				J Med Chem 48: 2262-5 (2005) Article DOI: 10.1021/jm048993p BindingDB Entry DOI: 10.7270/Q2VT1RM6
					More data for this Ligand-Target Pair				3D Structure (crystal)
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50164208 (2-(3-Methoxy-5,7-dipropyl-benzo[d]isoxazol-6-yloxy...) Show SMILES CCCc1cc2c(OC)noc2c(CCC)c1OC(C)(C)C(O)=O Show InChI InChI=1S/C18H25NO5/c1-6-8-11-10-13-15(24-19-16(13)22-5)12(9-7-2)14(11)23-18(3,4)17(20)21/h10H,6-9H2,1-5H3,(H,20,21)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	60	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Effective concentration against human Peroxisome proliferator activated receptor alpha in Gal4 transactivation assay				J Med Chem 48: 2262-5 (2005) Article DOI: 10.1021/jm048993p BindingDB Entry DOI: 10.7270/Q2VT1RM6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50164208 (2-(3-Methoxy-5,7-dipropyl-benzo[d]isoxazol-6-yloxy...) Show SMILES CCCc1cc2c(OC)noc2c(CCC)c1OC(C)(C)C(O)=O Show InChI InChI=1S/C18H25NO5/c1-6-8-11-10-13-15(24-19-16(13)22-5)12(9-7-2)14(11)23-18(3,4)17(20)21/h10H,6-9H2,1-5H3,(H,20,21)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Effective concentration against human Peroxisome proliferator activated receptor gamma in Gal4 transactivation assay				J Med Chem 48: 2262-5 (2005) Article DOI: 10.1021/jm048993p BindingDB Entry DOI: 10.7270/Q2VT1RM6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Mus musculus)	BDBM50164210 (2-(5,7-Dipropyl-3-trifluoromethyl-benzo[d]isoxazol...) Show SMILES CCCc1cc2c(noc2c(CCC)c1OC(C)(C)C(O)=O)C(F)(F)F Show InChI InChI=1S/C18H22F3NO4/c1-5-7-10-9-12-14(26-22-15(12)18(19,20)21)11(8-6-2)13(10)25-17(3,4)16(23)24/h9H,5-8H2,1-4H3,(H,23,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	180	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Agonist activity against mouse Peroxisome proliferator activated receptor alpha				J Med Chem 48: 2262-5 (2005) Article DOI: 10.1021/jm048993p BindingDB Entry DOI: 10.7270/Q2VT1RM6
					More data for this Ligand-Target Pair