Compile Data Set for Download or QSAR

Found 30 hits with Last Name = 'tousaint' and Initial = 'jj'   

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 (Mus musculus)	BDBM50448024 (CHEMBL3115242) Show SMILES CCCc1nn2ccc(cc2c1Cc1ccc(cc1)-c1ccccc1C(O)=O)-c1nc2ccccc2n1CCC Show InChI InChI=1S/C34H32N4O2/c1-3-9-29-28(21-23-14-16-24(17-15-23)26-10-5-6-11-27(26)34(39)40)32-22-25(18-20-38(32)36-29)33-35-30-12-7-8-13-31(30)37(33)19-4-2/h5-8,10-18,20,22H,3-4,9,19,21H2,1-2H3,(H,39,40)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Agonist activity at mouse PPARdelta expressed in CV-1 cells by reporter gene assay				Bioorg Med Chem Lett 24: 1098-103 (2014) Article DOI: 10.1016/j.bmcl.2014.01.004 BindingDB Entry DOI: 10.7270/Q2SQ91V1
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Mus musculus)	BDBM50448027 (CHEMBL3115245) Show SMILES CCCc1nn2ccc(cc2c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)C(=O)NC(CC)c1ccccc1 Show InChI InChI=1S/C34H33N7O/c1-3-10-31-29(21-23-15-17-24(18-16-23)27-13-8-9-14-28(27)33-36-39-40-37-33)32-22-26(19-20-41(32)38-31)34(42)35-30(4-2)25-11-6-5-7-12-25/h5-9,11-20,22,30H,3-4,10,21H2,1-2H3,(H,35,42)(H,36,37,39,40)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Agonist activity at mouse PPARdelta expressed in CV-1 cells by reporter gene assay				Bioorg Med Chem Lett 24: 1098-103 (2014) Article DOI: 10.1016/j.bmcl.2014.01.004 BindingDB Entry DOI: 10.7270/Q2SQ91V1
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Mus musculus)	BDBM50448028 (CHEMBL3115246) Show SMILES CCCCn1c(nc2ccccc12)-c1ccc2nn(CCC)c(Cc3ccc(cc3)-c3ccccc3C(O)=O)c2c1 Show InChI InChI=1S/C35H34N4O2/c1-3-5-21-38-32-13-9-8-12-31(32)36-34(38)26-18-19-30-29(23-26)33(39(37-30)20-4-2)22-24-14-16-25(17-15-24)27-10-6-7-11-28(27)35(40)41/h6-19,23H,3-5,20-22H2,1-2H3,(H,40,41)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Agonist activity at mouse PPARdelta expressed in CV-1 cells by reporter gene assay				Bioorg Med Chem Lett 24: 1098-103 (2014) Article DOI: 10.1016/j.bmcl.2014.01.004 BindingDB Entry DOI: 10.7270/Q2SQ91V1
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Mus musculus)	BDBM50448029 (CHEMBL3115247) Show SMILES CCCCn1c(nc2ccccc12)-c1ccc2nn(CCC)c(Cc3ccc(cc3)-c3ccccc3-c3nnn[nH]3)c2c1 Show InChI InChI=1S/C35H34N8/c1-3-5-21-42-32-13-9-8-12-31(32)36-35(42)26-18-19-30-29(23-26)33(43(39-30)20-4-2)22-24-14-16-25(17-15-24)27-10-6-7-11-28(27)34-37-40-41-38-34/h6-19,23H,3-5,20-22H2,1-2H3,(H,37,38,40,41)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Agonist activity at mouse PPARdelta expressed in CV-1 cells by reporter gene assay				Bioorg Med Chem Lett 24: 1098-103 (2014) Article DOI: 10.1016/j.bmcl.2014.01.004 BindingDB Entry DOI: 10.7270/Q2SQ91V1
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Mus musculus)	BDBM50448024 (CHEMBL3115242) Show SMILES CCCc1nn2ccc(cc2c1Cc1ccc(cc1)-c1ccccc1C(O)=O)-c1nc2ccccc2n1CCC Show InChI InChI=1S/C34H32N4O2/c1-3-9-29-28(21-23-14-16-24(17-15-23)26-10-5-6-11-27(26)34(39)40)32-22-25(18-20-38(32)36-29)33-35-30-12-7-8-13-31(30)37(33)19-4-2/h5-8,10-18,20,22H,3-4,9,19,21H2,1-2H3,(H,39,40)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Agonist activity at mouse PPARalpha expressed in CV-1 cells by reporter gene assay				Bioorg Med Chem Lett 24: 1098-103 (2014) Article DOI: 10.1016/j.bmcl.2014.01.004 BindingDB Entry DOI: 10.7270/Q2SQ91V1
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Mus musculus)	BDBM50448025 (CHEMBL3115243) Show SMILES CCCc1nn2ccc(cc2c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1nc2ccccc2n1CCC Show InChI InChI=1S/C34H32N8/c1-3-9-29-28(21-23-14-16-24(17-15-23)26-10-5-6-11-27(26)33-36-39-40-37-33)32-22-25(18-20-42(32)38-29)34-35-30-12-7-8-13-31(30)41(34)19-4-2/h5-8,10-18,20,22H,3-4,9,19,21H2,1-2H3,(H,36,37,39,40)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Agonist activity at mouse PPARalpha expressed in CV-1 cells by reporter gene assay				Bioorg Med Chem Lett 24: 1098-103 (2014) Article DOI: 10.1016/j.bmcl.2014.01.004 BindingDB Entry DOI: 10.7270/Q2SQ91V1
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Mus musculus)	BDBM50448027 (CHEMBL3115245) Show SMILES CCCc1nn2ccc(cc2c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)C(=O)NC(CC)c1ccccc1 Show InChI InChI=1S/C34H33N7O/c1-3-10-31-29(21-23-15-17-24(18-16-23)27-13-8-9-14-28(27)33-36-39-40-37-33)32-22-26(19-20-41(32)38-31)34(42)35-30(4-2)25-11-6-5-7-12-25/h5-9,11-20,22,30H,3-4,10,21H2,1-2H3,(H,35,42)(H,36,37,39,40)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	250	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Agonist activity at mouse PPARgamma expressed in CV-1 cells by reporter gene assay				Bioorg Med Chem Lett 24: 1098-103 (2014) Article DOI: 10.1016/j.bmcl.2014.01.004 BindingDB Entry DOI: 10.7270/Q2SQ91V1
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Mus musculus)	BDBM50448028 (CHEMBL3115246) Show SMILES CCCCn1c(nc2ccccc12)-c1ccc2nn(CCC)c(Cc3ccc(cc3)-c3ccccc3C(O)=O)c2c1 Show InChI InChI=1S/C35H34N4O2/c1-3-5-21-38-32-13-9-8-12-31(32)36-34(38)26-18-19-30-29(23-26)33(39(37-30)20-4-2)22-24-14-16-25(17-15-24)27-10-6-7-11-28(27)35(40)41/h6-19,23H,3-5,20-22H2,1-2H3,(H,40,41)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.39E+3	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Agonist activity at mouse PPARgamma expressed in CV-1 cells by reporter gene assay				Bioorg Med Chem Lett 24: 1098-103 (2014) Article DOI: 10.1016/j.bmcl.2014.01.004 BindingDB Entry DOI: 10.7270/Q2SQ91V1
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Mus musculus)	BDBM50448029 (CHEMBL3115247) Show SMILES CCCCn1c(nc2ccccc12)-c1ccc2nn(CCC)c(Cc3ccc(cc3)-c3ccccc3-c3nnn[nH]3)c2c1 Show InChI InChI=1S/C35H34N8/c1-3-5-21-42-32-13-9-8-12-31(32)36-35(42)26-18-19-30-29(23-26)33(43(39-30)20-4-2)22-24-14-16-25(17-15-24)27-10-6-7-11-28(27)34-37-40-41-38-34/h6-19,23H,3-5,20-22H2,1-2H3,(H,37,38,40,41)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Agonist activity at mouse PPARalpha expressed in CV-1 cells by reporter gene assay				Bioorg Med Chem Lett 24: 1098-103 (2014) Article DOI: 10.1016/j.bmcl.2014.01.004 BindingDB Entry DOI: 10.7270/Q2SQ91V1
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Mus musculus)	BDBM50448028 (CHEMBL3115246) Show SMILES CCCCn1c(nc2ccccc12)-c1ccc2nn(CCC)c(Cc3ccc(cc3)-c3ccccc3C(O)=O)c2c1 Show InChI InChI=1S/C35H34N4O2/c1-3-5-21-38-32-13-9-8-12-31(32)36-34(38)26-18-19-30-29(23-26)33(39(37-30)20-4-2)22-24-14-16-25(17-15-24)27-10-6-7-11-28(27)35(40)41/h6-19,23H,3-5,20-22H2,1-2H3,(H,40,41)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Agonist activity at mouse PPARalpha expressed in CV-1 cells by reporter gene assay				Bioorg Med Chem Lett 24: 1098-103 (2014) Article DOI: 10.1016/j.bmcl.2014.01.004 BindingDB Entry DOI: 10.7270/Q2SQ91V1
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Mus musculus)	BDBM50448030 (CHEMBL3115240) Show SMILES CCCc1[nH]c2ccc(cc2c1Cc1ccc(cc1)-c1ccccc1C(O)=O)C(=O)NC(CC)c1ccccc1 Show InChI InChI=1S/C35H34N2O3/c1-3-10-32-29(21-23-15-17-24(18-16-23)27-13-8-9-14-28(27)35(39)40)30-22-26(19-20-33(30)36-32)34(38)37-31(4-2)25-11-6-5-7-12-25/h5-9,11-20,22,31,36H,3-4,10,21H2,1-2H3,(H,37,38)(H,39,40)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Agonist activity at mouse PPARalpha expressed in CV-1 cells by reporter gene assay				Bioorg Med Chem Lett 24: 1098-103 (2014) Article DOI: 10.1016/j.bmcl.2014.01.004 BindingDB Entry DOI: 10.7270/Q2SQ91V1
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Mus musculus)	BDBM50448031 (CHEMBL3115239) Show SMILES CCCc1c(Cc2ccc(cc2)-c2ccccc2C(O)=O)c2cc(ccc2n1OC)C(=O)NC(CC)c1ccccc1 Show InChI InChI=1S/C36H36N2O4/c1-4-11-33-30(22-24-16-18-25(19-17-24)28-14-9-10-15-29(28)36(40)41)31-23-27(20-21-34(31)38(33)42-3)35(39)37-32(5-2)26-12-7-6-8-13-26/h6-10,12-21,23,32H,4-5,11,22H2,1-3H3,(H,37,39)(H,40,41)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Agonist activity at mouse PPARalpha expressed in CV-1 cells by reporter gene assay				Bioorg Med Chem Lett 24: 1098-103 (2014) Article DOI: 10.1016/j.bmcl.2014.01.004 BindingDB Entry DOI: 10.7270/Q2SQ91V1
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Mus musculus)	BDBM50448031 (CHEMBL3115239) Show SMILES CCCc1c(Cc2ccc(cc2)-c2ccccc2C(O)=O)c2cc(ccc2n1OC)C(=O)NC(CC)c1ccccc1 Show InChI InChI=1S/C36H36N2O4/c1-4-11-33-30(22-24-16-18-25(19-17-24)28-14-9-10-15-29(28)36(40)41)31-23-27(20-21-34(31)38(33)42-3)35(39)37-32(5-2)26-12-7-6-8-13-26/h6-10,12-21,23,32H,4-5,11,22H2,1-3H3,(H,37,39)(H,40,41)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Agonist activity at mouse PPARdelta expressed in CV-1 cells by reporter gene assay				Bioorg Med Chem Lett 24: 1098-103 (2014) Article DOI: 10.1016/j.bmcl.2014.01.004 BindingDB Entry DOI: 10.7270/Q2SQ91V1
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Mus musculus)	BDBM50448032 (CHEMBL3115238) Show SMILES CCCc1[nH]c2cc(ccc2c1Cc1ccc(cc1)-c1ccccc1C(O)=O)C(=O)NC(CC)c1ccccc1 Show InChI InChI=1S/C35H34N2O3/c1-3-10-32-30(21-23-15-17-24(18-16-23)27-13-8-9-14-29(27)35(39)40)28-20-19-26(22-33(28)36-32)34(38)37-31(4-2)25-11-6-5-7-12-25/h5-9,11-20,22,31,36H,3-4,10,21H2,1-2H3,(H,37,38)(H,39,40)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	790	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Agonist activity at mouse PPARalpha expressed in CV-1 cells by reporter gene assay				Bioorg Med Chem Lett 24: 1098-103 (2014) Article DOI: 10.1016/j.bmcl.2014.01.004 BindingDB Entry DOI: 10.7270/Q2SQ91V1
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Mus musculus)	BDBM50448033 (CHEMBL3115237) Show SMILES CCCc1c(Cc2ccc(cc2)-c2ccccc2C(O)=O)c2ccc(cc2n1C)C(=O)NC(CC)c1ccccc1 Show InChI InChI=1S/C36H36N2O3/c1-4-11-33-31(22-24-16-18-25(19-17-24)28-14-9-10-15-30(28)36(40)41)29-21-20-27(23-34(29)38(33)3)35(39)37-32(5-2)26-12-7-6-8-13-26/h6-10,12-21,23,32H,4-5,11,22H2,1-3H3,(H,37,39)(H,40,41)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	170	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Agonist activity at mouse PPARalpha expressed in CV-1 cells by reporter gene assay				Bioorg Med Chem Lett 24: 1098-103 (2014) Article DOI: 10.1016/j.bmcl.2014.01.004 BindingDB Entry DOI: 10.7270/Q2SQ91V1
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Mus musculus)	BDBM50448027 (CHEMBL3115245) Show SMILES CCCc1nn2ccc(cc2c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)C(=O)NC(CC)c1ccccc1 Show InChI InChI=1S/C34H33N7O/c1-3-10-31-29(21-23-15-17-24(18-16-23)27-13-8-9-14-28(27)33-36-39-40-37-33)32-22-26(19-20-41(32)38-31)34(42)35-30(4-2)25-11-6-5-7-12-25/h5-9,11-20,22,30H,3-4,10,21H2,1-2H3,(H,35,42)(H,36,37,39,40)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Agonist activity at mouse PPARalpha expressed in CV-1 cells by reporter gene assay				Bioorg Med Chem Lett 24: 1098-103 (2014) Article DOI: 10.1016/j.bmcl.2014.01.004 BindingDB Entry DOI: 10.7270/Q2SQ91V1
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Mus musculus)	BDBM50448026 (CHEMBL3115244) Show SMILES CCCn1nc2ccc(cc2c1Cc1ccc(cc1)-c1ccccc1C(O)=O)C(=O)NC(CC)c1ccccc1 Show InChI InChI=1S/C34H33N3O3/c1-3-20-37-32(21-23-14-16-24(17-15-23)27-12-8-9-13-28(27)34(39)40)29-22-26(18-19-31(29)36-37)33(38)35-30(4-2)25-10-6-5-7-11-25/h5-19,22,30H,3-4,20-21H2,1-2H3,(H,35,38)(H,39,40)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Agonist activity at mouse PPARalpha expressed in CV-1 cells by reporter gene assay				Bioorg Med Chem Lett 24: 1098-103 (2014) Article DOI: 10.1016/j.bmcl.2014.01.004 BindingDB Entry DOI: 10.7270/Q2SQ91V1
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Mus musculus)	BDBM50448029 (CHEMBL3115247) Show SMILES CCCCn1c(nc2ccccc12)-c1ccc2nn(CCC)c(Cc3ccc(cc3)-c3ccccc3-c3nnn[nH]3)c2c1 Show InChI InChI=1S/C35H34N8/c1-3-5-21-42-32-13-9-8-12-31(32)36-35(42)26-18-19-30-29(23-26)33(43(39-30)20-4-2)22-24-14-16-25(17-15-24)27-10-6-7-11-28(27)34-37-40-41-38-34/h6-19,23H,3-5,20-22H2,1-2H3,(H,37,38,40,41)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	270	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Partial agonist activity at mouse PPARgamma expressed in CV-1 cells by reporter gene assay				Bioorg Med Chem Lett 24: 1098-103 (2014) Article DOI: 10.1016/j.bmcl.2014.01.004 BindingDB Entry DOI: 10.7270/Q2SQ91V1
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Mus musculus)	BDBM50448034 (CHEMBL3115241) Show SMILES CCCc1nn2ccc(cc2c1Cc1ccc(cc1)-c1ccccc1C(O)=O)C(=O)NC(CC)c1ccccc1 Show InChI InChI=1S/C34H33N3O3/c1-3-10-31-29(21-23-15-17-24(18-16-23)27-13-8-9-14-28(27)34(39)40)32-22-26(19-20-37(32)36-31)33(38)35-30(4-2)25-11-6-5-7-12-25/h5-9,11-20,22,30H,3-4,10,21H2,1-2H3,(H,35,38)(H,39,40)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Agonist activity at mouse PPARdelta expressed in CV-1 cells by reporter gene assay				Bioorg Med Chem Lett 24: 1098-103 (2014) Article DOI: 10.1016/j.bmcl.2014.01.004 BindingDB Entry DOI: 10.7270/Q2SQ91V1
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Mus musculus)	BDBM50448026 (CHEMBL3115244) Show SMILES CCCn1nc2ccc(cc2c1Cc1ccc(cc1)-c1ccccc1C(O)=O)C(=O)NC(CC)c1ccccc1 Show InChI InChI=1S/C34H33N3O3/c1-3-20-37-32(21-23-14-16-24(17-15-23)27-12-8-9-13-28(27)34(39)40)29-22-26(18-19-31(29)36-37)33(38)35-30(4-2)25-10-6-5-7-11-25/h5-19,22,30H,3-4,20-21H2,1-2H3,(H,35,38)(H,39,40)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	250	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Partial agonist activity at mouse PPARgamma expressed in CV-1 cells by reporter gene assay				Bioorg Med Chem Lett 24: 1098-103 (2014) Article DOI: 10.1016/j.bmcl.2014.01.004 BindingDB Entry DOI: 10.7270/Q2SQ91V1
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Mus musculus)	BDBM50448034 (CHEMBL3115241) Show SMILES CCCc1nn2ccc(cc2c1Cc1ccc(cc1)-c1ccccc1C(O)=O)C(=O)NC(CC)c1ccccc1 Show InChI InChI=1S/C34H33N3O3/c1-3-10-31-29(21-23-15-17-24(18-16-23)27-13-8-9-14-28(27)34(39)40)32-22-26(19-20-37(32)36-31)33(38)35-30(4-2)25-11-6-5-7-12-25/h5-9,11-20,22,30H,3-4,10,21H2,1-2H3,(H,35,38)(H,39,40)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Agonist activity at mouse PPARalpha expressed in CV-1 cells by reporter gene assay				Bioorg Med Chem Lett 24: 1098-103 (2014) Article DOI: 10.1016/j.bmcl.2014.01.004 BindingDB Entry DOI: 10.7270/Q2SQ91V1
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Mus musculus)	BDBM50448025 (CHEMBL3115243) Show SMILES CCCc1nn2ccc(cc2c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1nc2ccccc2n1CCC Show InChI InChI=1S/C34H32N8/c1-3-9-29-28(21-23-14-16-24(17-15-23)26-10-5-6-11-27(26)33-36-39-40-37-33)32-22-25(18-20-42(32)38-29)34-35-30-12-7-8-13-31(30)41(34)19-4-2/h5-8,10-18,20,22H,3-4,9,19,21H2,1-2H3,(H,36,37,39,40)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	130	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Agonist activity at mouse PPARgamma expressed in CV-1 cells by reporter gene assay				Bioorg Med Chem Lett 24: 1098-103 (2014) Article DOI: 10.1016/j.bmcl.2014.01.004 BindingDB Entry DOI: 10.7270/Q2SQ91V1
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Mus musculus)	BDBM50448024 (CHEMBL3115242) Show SMILES CCCc1nn2ccc(cc2c1Cc1ccc(cc1)-c1ccccc1C(O)=O)-c1nc2ccccc2n1CCC Show InChI InChI=1S/C34H32N4O2/c1-3-9-29-28(21-23-14-16-24(17-15-23)26-10-5-6-11-27(26)34(39)40)32-22-25(18-20-38(32)36-29)33-35-30-12-7-8-13-31(30)37(33)19-4-2/h5-8,10-18,20,22H,3-4,9,19,21H2,1-2H3,(H,39,40)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	380	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Agonist activity at mouse PPARgamma expressed in CV-1 cells by reporter gene assay				Bioorg Med Chem Lett 24: 1098-103 (2014) Article DOI: 10.1016/j.bmcl.2014.01.004 BindingDB Entry DOI: 10.7270/Q2SQ91V1
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Mus musculus)	BDBM50448034 (CHEMBL3115241) Show SMILES CCCc1nn2ccc(cc2c1Cc1ccc(cc1)-c1ccccc1C(O)=O)C(=O)NC(CC)c1ccccc1 Show InChI InChI=1S/C34H33N3O3/c1-3-10-31-29(21-23-15-17-24(18-16-23)27-13-8-9-14-28(27)34(39)40)32-22-26(19-20-37(32)36-31)33(38)35-30(4-2)25-11-6-5-7-12-25/h5-9,11-20,22,30H,3-4,10,21H2,1-2H3,(H,35,38)(H,39,40)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.02E+3	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Agonist activity at mouse PPARgamma expressed in CV-1 cells by reporter gene assay				Bioorg Med Chem Lett 24: 1098-103 (2014) Article DOI: 10.1016/j.bmcl.2014.01.004 BindingDB Entry DOI: 10.7270/Q2SQ91V1
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Mus musculus)	BDBM50448030 (CHEMBL3115240) Show SMILES CCCc1[nH]c2ccc(cc2c1Cc1ccc(cc1)-c1ccccc1C(O)=O)C(=O)NC(CC)c1ccccc1 Show InChI InChI=1S/C35H34N2O3/c1-3-10-32-29(21-23-15-17-24(18-16-23)27-13-8-9-14-28(27)35(39)40)30-22-26(19-20-33(30)36-32)34(38)37-31(4-2)25-11-6-5-7-12-25/h5-9,11-20,22,31,36H,3-4,10,21H2,1-2H3,(H,37,38)(H,39,40)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	510	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Agonist activity at mouse PPARgamma expressed in CV-1 cells by reporter gene assay				Bioorg Med Chem Lett 24: 1098-103 (2014) Article DOI: 10.1016/j.bmcl.2014.01.004 BindingDB Entry DOI: 10.7270/Q2SQ91V1
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Mus musculus)	BDBM50448031 (CHEMBL3115239) Show SMILES CCCc1c(Cc2ccc(cc2)-c2ccccc2C(O)=O)c2cc(ccc2n1OC)C(=O)NC(CC)c1ccccc1 Show InChI InChI=1S/C36H36N2O4/c1-4-11-33-30(22-24-16-18-25(19-17-24)28-14-9-10-15-29(28)36(40)41)31-23-27(20-21-34(31)38(33)42-3)35(39)37-32(5-2)26-12-7-6-8-13-26/h6-10,12-21,23,32H,4-5,11,22H2,1-3H3,(H,37,39)(H,40,41)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	200	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Agonist activity at mouse PPARgamma expressed in CV-1 cells by reporter gene assay				Bioorg Med Chem Lett 24: 1098-103 (2014) Article DOI: 10.1016/j.bmcl.2014.01.004 BindingDB Entry DOI: 10.7270/Q2SQ91V1
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Mus musculus)	BDBM50448032 (CHEMBL3115238) Show SMILES CCCc1[nH]c2cc(ccc2c1Cc1ccc(cc1)-c1ccccc1C(O)=O)C(=O)NC(CC)c1ccccc1 Show InChI InChI=1S/C35H34N2O3/c1-3-10-32-30(21-23-15-17-24(18-16-23)27-13-8-9-14-29(27)35(39)40)28-20-19-26(22-33(28)36-32)34(38)37-31(4-2)25-11-6-5-7-12-25/h5-9,11-20,22,31,36H,3-4,10,21H2,1-2H3,(H,37,38)(H,39,40)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	9	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Agonist activity at mouse PPARgamma expressed in CV-1 cells by reporter gene assay				Bioorg Med Chem Lett 24: 1098-103 (2014) Article DOI: 10.1016/j.bmcl.2014.01.004 BindingDB Entry DOI: 10.7270/Q2SQ91V1
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Mus musculus)	BDBM50448033 (CHEMBL3115237) Show SMILES CCCc1c(Cc2ccc(cc2)-c2ccccc2C(O)=O)c2ccc(cc2n1C)C(=O)NC(CC)c1ccccc1 Show InChI InChI=1S/C36H36N2O3/c1-4-11-33-31(22-24-16-18-25(19-17-24)28-14-9-10-15-30(28)36(40)41)29-21-20-27(23-34(29)38(33)3)35(39)37-32(5-2)26-12-7-6-8-13-26/h6-10,12-21,23,32H,4-5,11,22H2,1-3H3,(H,37,39)(H,40,41)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	3	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Agonist activity at mouse PPARgamma expressed in CV-1 cells by reporter gene assay				Bioorg Med Chem Lett 24: 1098-103 (2014) Article DOI: 10.1016/j.bmcl.2014.01.004 BindingDB Entry DOI: 10.7270/Q2SQ91V1
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Mus musculus)	BDBM50448026 (CHEMBL3115244) Show SMILES CCCn1nc2ccc(cc2c1Cc1ccc(cc1)-c1ccccc1C(O)=O)C(=O)NC(CC)c1ccccc1 Show InChI InChI=1S/C34H33N3O3/c1-3-20-37-32(21-23-14-16-24(17-15-23)27-12-8-9-13-28(27)34(39)40)29-22-26(18-19-31(29)36-37)33(38)35-30(4-2)25-10-6-5-7-11-25/h5-19,22,30H,3-4,20-21H2,1-2H3,(H,35,38)(H,39,40)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Agonist activity at mouse PPARdelta expressed in CV-1 cells by reporter gene assay				Bioorg Med Chem Lett 24: 1098-103 (2014) Article DOI: 10.1016/j.bmcl.2014.01.004 BindingDB Entry DOI: 10.7270/Q2SQ91V1
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Mus musculus)	BDBM50448025 (CHEMBL3115243) Show SMILES CCCc1nn2ccc(cc2c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1nc2ccccc2n1CCC Show InChI InChI=1S/C34H32N8/c1-3-9-29-28(21-23-14-16-24(17-15-23)26-10-5-6-11-27(26)33-36-39-40-37-33)32-22-25(18-20-42(32)38-29)34-35-30-12-7-8-13-31(30)41(34)19-4-2/h5-8,10-18,20,22H,3-4,9,19,21H2,1-2H3,(H,36,37,39,40)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Agonist activity at mouse PPARdelta expressed in CV-1 cells by reporter gene assay				Bioorg Med Chem Lett 24: 1098-103 (2014) Article DOI: 10.1016/j.bmcl.2014.01.004 BindingDB Entry DOI: 10.7270/Q2SQ91V1
					More data for this Ligand-Target Pair