Compile Data Set for Download or QSAR

Found 63 hits with Last Name = 'stuart' and Initial = 'lw'   

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))	BDBM50099485 (2-(4-{2-[1-(2-Biphenyl-4-yl-ethyl)-3-(4-isopropyl-...) Show SMILES CC(C)c1ccc(NC(=O)N(CCc2ccc(SC(C)(C)C(O)=O)cc2)CCc2ccc(cc2)-c2ccccc2)cc1 Show InChI InChI=1S/C36H40N2O3S/c1-26(2)29-16-18-32(19-17-29)37-35(41)38(24-22-27-10-14-31(15-11-27)30-8-6-5-7-9-30)25-23-28-12-20-33(21-13-28)42-36(3,4)34(39)40/h5-21,26H,22-25H2,1-4H3,(H,37,41)(H,39,40)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	17	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description In vitro transcriptional activation in CV-1 cells expressing human Gal4-PPAR alpha ligand binding domain				Bioorg Med Chem Lett 11: 1225-7 (2001) BindingDB Entry DOI: 10.7270/Q2Z31XX0
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50099485 (2-(4-{2-[1-(2-Biphenyl-4-yl-ethyl)-3-(4-isopropyl-...) Show SMILES CC(C)c1ccc(NC(=O)N(CCc2ccc(SC(C)(C)C(O)=O)cc2)CCc2ccc(cc2)-c2ccccc2)cc1 Show InChI InChI=1S/C36H40N2O3S/c1-26(2)29-16-18-32(19-17-29)37-35(41)38(24-22-27-10-14-31(15-11-27)30-8-6-5-7-9-30)25-23-28-12-20-33(21-13-28)42-36(3,4)34(39)40/h5-21,26H,22-25H2,1-4H3,(H,37,41)(H,39,40)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	17	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description In vitro transcriptional activation in CV-1 cells expressing human Gal4-PPAR alpha ligand binding domain				Bioorg Med Chem Lett 11: 1225-7 (2001) BindingDB Entry DOI: 10.7270/Q2Z31XX0
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50099485 (2-(4-{2-[1-(2-Biphenyl-4-yl-ethyl)-3-(4-isopropyl-...) Show SMILES CC(C)c1ccc(NC(=O)N(CCc2ccc(SC(C)(C)C(O)=O)cc2)CCc2ccc(cc2)-c2ccccc2)cc1 Show InChI InChI=1S/C36H40N2O3S/c1-26(2)29-16-18-32(19-17-29)37-35(41)38(24-22-27-10-14-31(15-11-27)30-8-6-5-7-9-30)25-23-28-12-20-33(21-13-28)42-36(3,4)34(39)40/h5-21,26H,22-25H2,1-4H3,(H,37,41)(H,39,40)	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	n/a	n/a	8.50E+3	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description In vitro transcriptional activation in CV-1 cells expressing human Gal4-PPAR gamma ligand binding domain				Bioorg Med Chem Lett 11: 1225-7 (2001) BindingDB Entry DOI: 10.7270/Q2Z31XX0
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50099485 (2-(4-{2-[1-(2-Biphenyl-4-yl-ethyl)-3-(4-isopropyl-...) Show SMILES CC(C)c1ccc(NC(=O)N(CCc2ccc(SC(C)(C)C(O)=O)cc2)CCc2ccc(cc2)-c2ccccc2)cc1 Show InChI InChI=1S/C36H40N2O3S/c1-26(2)29-16-18-32(19-17-29)37-35(41)38(24-22-27-10-14-31(15-11-27)30-8-6-5-7-9-30)25-23-28-12-20-33(21-13-28)42-36(3,4)34(39)40/h5-21,26H,22-25H2,1-4H3,(H,37,41)(H,39,40)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description In vitro transcriptional activation in CV-1 cells expressing human Gal4-PPAR delta ligand binding domain				Bioorg Med Chem Lett 11: 1225-7 (2001) BindingDB Entry DOI: 10.7270/Q2Z31XX0
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50099487 (2-(4-{2-[1-(2-Biphenyl-4-yl-ethyl)-3-cyclohexyl-ur...) Show SMILES CC(C)(Sc1ccc(CCN(CCc2ccc(cc2)-c2ccccc2)C(=O)NC2CCCCC2)cc1)C(O)=O Show InChI InChI=1S/C33H40N2O3S/c1-33(2,31(36)37)39-30-19-15-26(16-20-30)22-24-35(32(38)34-29-11-7-4-8-12-29)23-21-25-13-17-28(18-14-25)27-9-5-3-6-10-27/h3,5-6,9-10,13-20,29H,4,7-8,11-12,21-24H2,1-2H3,(H,34,38)(H,36,37)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description In vitro transcriptional activation in CV-1 cells expressing human Gal4-PPAR delta ligand binding domain				Bioorg Med Chem Lett 11: 1225-7 (2001) BindingDB Entry DOI: 10.7270/Q2Z31XX0
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50099484 (2-(4-{2-[1-(2-Biphenyl-4-yl-ethyl)-3-(2,4-dimethox...) Show SMILES COc1ccc(NC(=O)N(CCc2ccc(SC(C)(C)C(O)=O)cc2)CCc2ccc(cc2)-c2ccccc2)c(OC)c1 Show InChI InChI=1S/C35H38N2O5S/c1-35(2,33(38)39)43-30-17-12-26(13-18-30)21-23-37(34(40)36-31-19-16-29(41-3)24-32(31)42-4)22-20-25-10-14-28(15-11-25)27-8-6-5-7-9-27/h5-19,24H,20-23H2,1-4H3,(H,36,40)(H,38,39)	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	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description In vitro transcriptional activation in CV-1 cells expressing human Gal4-PPAR gamma ligand binding domain				Bioorg Med Chem Lett 11: 1225-7 (2001) BindingDB Entry DOI: 10.7270/Q2Z31XX0
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50099488 (2-(4-{2-[3-(3-Cyano-phenyl)-1-(4-cyclohexyl-butyl)...) Show SMILES CC(C)(Sc1ccc(CCN(CCCCC2CCCCC2)C(=O)Nc2cccc(c2)C#N)cc1)C(O)=O Show InChI InChI=1S/C30H39N3O3S/c1-30(2,28(34)35)37-27-16-14-24(15-17-27)18-20-33(19-7-6-11-23-9-4-3-5-10-23)29(36)32-26-13-8-12-25(21-26)22-31/h8,12-17,21,23H,3-7,9-11,18-20H2,1-2H3,(H,32,36)(H,34,35)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	9	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description In vitro transcriptional activation in CV-1 cells expressing human Gal4-PPAR alpha ligand binding domain				Bioorg Med Chem Lett 11: 1225-7 (2001) BindingDB Entry DOI: 10.7270/Q2Z31XX0
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50099489 (2-(4-{2-[1-(4-Cyclohexyl-butyl)-3-(2-methoxy-pheny...) Show SMILES COc1ccccc1NC(=O)N(CCCCC1CCCCC1)CCc1ccc(SC(C)(C)C(O)=O)cc1 Show InChI InChI=1S/C30H42N2O4S/c1-30(2,28(33)34)37-25-18-16-24(17-19-25)20-22-32(21-10-9-13-23-11-5-4-6-12-23)29(35)31-26-14-7-8-15-27(26)36-3/h7-8,14-19,23H,4-6,9-13,20-22H2,1-3H3,(H,31,35)(H,33,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	5	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description In vitro transcriptional activation in CV-1 cells expressing human Gal4-PPAR alpha ligand binding domain				Bioorg Med Chem Lett 11: 1225-7 (2001) BindingDB Entry DOI: 10.7270/Q2Z31XX0
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50099487 (2-(4-{2-[1-(2-Biphenyl-4-yl-ethyl)-3-cyclohexyl-ur...) Show SMILES CC(C)(Sc1ccc(CCN(CCc2ccc(cc2)-c2ccccc2)C(=O)NC2CCCCC2)cc1)C(O)=O Show InChI InChI=1S/C33H40N2O3S/c1-33(2,31(36)37)39-30-19-15-26(16-20-30)22-24-35(32(38)34-29-11-7-4-8-12-29)23-21-25-13-17-28(18-14-25)27-9-5-3-6-10-27/h3,5-6,9-10,13-20,29H,4,7-8,11-12,21-24H2,1-2H3,(H,34,38)(H,36,37)	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	n/a	n/a	2.40E+3	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description In vitro transcriptional activation in CV-1 cells expressing human Gal4-PPAR gamma ligand binding domain				Bioorg Med Chem Lett 11: 1225-7 (2001) BindingDB Entry DOI: 10.7270/Q2Z31XX0
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Mus musculus)	BDBM50099491 (2-(4-(2-(3-cyclohexyl-1-(4-cyclohexylbutyl)ureido)...) Show SMILES CC(C)(Sc1ccc(CCN(CCCCC2CCCCC2)C(=O)NC2CCCCC2)cc1)C(O)=O Show InChI InChI=1S/C29H46N2O3S/c1-29(2,27(32)33)35-26-18-16-24(17-19-26)20-22-31(28(34)30-25-14-7-4-8-15-25)21-10-9-13-23-11-5-3-6-12-23/h16-19,23,25H,3-15,20-22H2,1-2H3,(H,30,34)(H,32,33)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Patents Similars	PDB PubMed	n/a	n/a	n/a	n/a	1	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Activation of murine PPAR alpha ligand binding domain				Bioorg Med Chem Lett 11: 1225-7 (2001) BindingDB Entry DOI: 10.7270/Q2Z31XX0
					More data for this Ligand-Target Pair				3D Structure (crystal)
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50099490 (2-(4-{2-[1-(2-Biphenyl-4-yl-ethyl)-3-(2-methoxy-5-...) Show SMILES COc1ccc(C)cc1NC(=O)N(CCc1ccc(SC(C)(C)C(O)=O)cc1)CCc1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C35H38N2O4S/c1-25-10-19-32(41-4)31(24-25)36-34(40)37(22-20-26-11-15-29(16-12-26)28-8-6-5-7-9-28)23-21-27-13-17-30(18-14-27)42-35(2,3)33(38)39/h5-19,24H,20-23H2,1-4H3,(H,36,40)(H,38,39)	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	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description In vitro transcriptional activation in CV-1 cells expressing human Gal4-PPAR gamma ligand binding domain				Bioorg Med Chem Lett 11: 1225-7 (2001) BindingDB Entry DOI: 10.7270/Q2Z31XX0
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50099491 (2-(4-(2-(3-cyclohexyl-1-(4-cyclohexylbutyl)ureido)...) Show SMILES CC(C)(Sc1ccc(CCN(CCCCC2CCCCC2)C(=O)NC2CCCCC2)cc1)C(O)=O Show InChI InChI=1S/C29H46N2O3S/c1-29(2,27(32)33)35-26-18-16-24(17-19-26)20-22-31(28(34)30-25-14-7-4-8-15-25)21-10-9-13-23-11-5-3-6-12-23/h16-19,23,25H,3-15,20-22H2,1-2H3,(H,30,34)(H,32,33)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Patents Similars	PubMed	n/a	n/a	n/a	n/a	6.20E+3	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description In vitro transcriptional activation in CV-1 cells expressing human Gal4-PPAR delta ligand binding domain				Bioorg Med Chem Lett 11: 1225-7 (2001) BindingDB Entry DOI: 10.7270/Q2Z31XX0
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50099484 (2-(4-{2-[1-(2-Biphenyl-4-yl-ethyl)-3-(2,4-dimethox...) Show SMILES COc1ccc(NC(=O)N(CCc2ccc(SC(C)(C)C(O)=O)cc2)CCc2ccc(cc2)-c2ccccc2)c(OC)c1 Show InChI InChI=1S/C35H38N2O5S/c1-35(2,33(38)39)43-30-17-12-26(13-18-30)21-23-37(34(40)36-31-19-16-29(41-3)24-32(31)42-4)22-20-25-10-14-28(15-11-25)27-8-6-5-7-9-27/h5-19,24H,20-23H2,1-4H3,(H,36,40)(H,38,39)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	4.00E+3	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description In vitro transcriptional activation in CV-1 cells expressing human Gal4-PPAR delta ligand binding domain				Bioorg Med Chem Lett 11: 1225-7 (2001) BindingDB Entry DOI: 10.7270/Q2Z31XX0
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM28799 (2-{[4-(2-{[(2,4-difluorophenyl)carbamoyl](heptyl)a...) Show SMILES CCCCCCCN(CCc1ccc(SC(C)(C)C(O)=O)cc1)C(=O)Nc1ccc(F)cc1F Show InChI InChI=1S/C26H34F2N2O3S/c1-4-5-6-7-8-16-30(25(33)29-23-14-11-20(27)18-22(23)28)17-15-19-9-12-21(13-10-19)34-26(2,3)24(31)32/h9-14,18H,4-8,15-17H2,1-3H3,(H,29,33)(H,31,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	n/a	n/a	1.40E+3	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description In vitro transcriptional activation in CV-1 cells expressing human Gal4-PPAR delta ligand binding domain				Bioorg Med Chem Lett 11: 1225-7 (2001) BindingDB Entry DOI: 10.7270/Q2Z31XX0
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Mus musculus)	BDBM50099491 (2-(4-(2-(3-cyclohexyl-1-(4-cyclohexylbutyl)ureido)...) Show SMILES CC(C)(Sc1ccc(CCN(CCCCC2CCCCC2)C(=O)NC2CCCCC2)cc1)C(O)=O Show InChI InChI=1S/C29H46N2O3S/c1-29(2,27(32)33)35-26-18-16-24(17-19-26)20-22-31(28(34)30-25-14-7-4-8-15-25)21-10-9-13-23-11-5-3-6-12-23/h16-19,23,25H,3-15,20-22H2,1-2H3,(H,30,34)(H,32,33)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Patents Similars	PubMed	n/a	n/a	n/a	n/a	1.30E+3	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Activation of murine PPAR gamma ligand binding domain				Bioorg Med Chem Lett 11: 1225-7 (2001) BindingDB Entry DOI: 10.7270/Q2Z31XX0
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM28799 (2-{[4-(2-{[(2,4-difluorophenyl)carbamoyl](heptyl)a...) Show SMILES CCCCCCCN(CCc1ccc(SC(C)(C)C(O)=O)cc1)C(=O)Nc1ccc(F)cc1F Show InChI InChI=1S/C26H34F2N2O3S/c1-4-5-6-7-8-16-30(25(33)29-23-14-11-20(27)18-22(23)28)17-15-19-9-12-21(13-10-19)34-26(2,3)24(31)32/h9-14,18H,4-8,15-17H2,1-3H3,(H,29,33)(H,31,32)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description In vitro transcriptional activation in CV-1 cells expressing human Gal4-PPAR gamma ligand binding domain				Bioorg Med Chem Lett 11: 1225-7 (2001) BindingDB Entry DOI: 10.7270/Q2Z31XX0
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50099490 (2-(4-{2-[1-(2-Biphenyl-4-yl-ethyl)-3-(2-methoxy-5-...) Show SMILES COc1ccc(C)cc1NC(=O)N(CCc1ccc(SC(C)(C)C(O)=O)cc1)CCc1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C35H38N2O4S/c1-25-10-19-32(41-4)31(24-25)36-34(40)37(22-20-26-11-15-29(16-12-26)28-8-6-5-7-9-28)23-21-27-13-17-30(18-14-27)42-35(2,3)33(38)39/h5-19,24H,20-23H2,1-4H3,(H,36,40)(H,38,39)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description In vitro transcriptional activation in CV-1 cells expressing human Gal4-PPAR delta ligand binding domain				Bioorg Med Chem Lett 11: 1225-7 (2001) BindingDB Entry DOI: 10.7270/Q2Z31XX0
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50099488 (2-(4-{2-[3-(3-Cyano-phenyl)-1-(4-cyclohexyl-butyl)...) Show SMILES CC(C)(Sc1ccc(CCN(CCCCC2CCCCC2)C(=O)Nc2cccc(c2)C#N)cc1)C(O)=O Show InChI InChI=1S/C30H39N3O3S/c1-30(2,28(34)35)37-27-16-14-24(15-17-27)18-20-33(19-7-6-11-23-9-4-3-5-10-23)29(36)32-26-13-8-12-25(21-26)22-31/h8,12-17,21,23H,3-7,9-11,18-20H2,1-2H3,(H,32,36)(H,34,35)	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	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description In vitro transcriptional activation in CV-1 cells expressing human Gal4-PPAR gamma ligand binding domain				Bioorg Med Chem Lett 11: 1225-7 (2001) BindingDB Entry DOI: 10.7270/Q2Z31XX0
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50099490 (2-(4-{2-[1-(2-Biphenyl-4-yl-ethyl)-3-(2-methoxy-5-...) Show SMILES COc1ccc(C)cc1NC(=O)N(CCc1ccc(SC(C)(C)C(O)=O)cc1)CCc1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C35H38N2O4S/c1-25-10-19-32(41-4)31(24-25)36-34(40)37(22-20-26-11-15-29(16-12-26)28-8-6-5-7-9-28)23-21-27-13-17-30(18-14-27)42-35(2,3)33(38)39/h5-19,24H,20-23H2,1-4H3,(H,36,40)(H,38,39)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	100	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description In vitro transcriptional activation in CV-1 cells expressing human Gal4-PPAR alpha ligand binding domain				Bioorg Med Chem Lett 11: 1225-7 (2001) BindingDB Entry DOI: 10.7270/Q2Z31XX0
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50099492 (2-(4-{2-[1-(4-Cyclohexyl-butyl)-3-(4-methyl-3-nitr...) Show SMILES Cc1ccc(NC(=O)N(CCCCC2CCCCC2)CCc2ccc(SC(C)(C)C(O)=O)cc2)cc1[N+]([O-])=O Show InChI InChI=1S/C30H41N3O5S/c1-22-12-15-25(21-27(22)33(37)38)31-29(36)32(19-8-7-11-23-9-5-4-6-10-23)20-18-24-13-16-26(17-14-24)39-30(2,3)28(34)35/h12-17,21,23H,4-11,18-20H2,1-3H3,(H,31,36)(H,34,35)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description In vitro transcriptional activation in CV-1 cells expressing human Gal4-PPAR gamma ligand binding domain				Bioorg Med Chem Lett 11: 1225-7 (2001) BindingDB Entry DOI: 10.7270/Q2Z31XX0
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50099491 (2-(4-(2-(3-cyclohexyl-1-(4-cyclohexylbutyl)ureido)...) Show SMILES CC(C)(Sc1ccc(CCN(CCCCC2CCCCC2)C(=O)NC2CCCCC2)cc1)C(O)=O Show InChI InChI=1S/C29H46N2O3S/c1-29(2,27(32)33)35-26-18-16-24(17-19-26)20-22-31(28(34)30-25-14-7-4-8-15-25)21-10-9-13-23-11-5-3-6-12-23/h16-19,23,25H,3-15,20-22H2,1-2H3,(H,30,34)(H,32,33)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Patents Similars	PubMed	n/a	n/a	n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description In vitro transcriptional activation in CV-1 cells expressing human Gal4-PPAR gamma ligand binding domain				Bioorg Med Chem Lett 11: 1225-7 (2001) BindingDB Entry DOI: 10.7270/Q2Z31XX0
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50099487 (2-(4-{2-[1-(2-Biphenyl-4-yl-ethyl)-3-cyclohexyl-ur...) Show SMILES CC(C)(Sc1ccc(CCN(CCc2ccc(cc2)-c2ccccc2)C(=O)NC2CCCCC2)cc1)C(O)=O Show InChI InChI=1S/C33H40N2O3S/c1-33(2,31(36)37)39-30-19-15-26(16-20-30)22-24-35(32(38)34-29-11-7-4-8-12-29)23-21-25-13-17-28(18-14-25)27-9-5-3-6-10-27/h3,5-6,9-10,13-20,29H,4,7-8,11-12,21-24H2,1-2H3,(H,34,38)(H,36,37)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	8	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description In vitro transcriptional activation in CV-1 cells expressing human Gal4-PPAR alpha ligand binding domain				Bioorg Med Chem Lett 11: 1225-7 (2001) BindingDB Entry DOI: 10.7270/Q2Z31XX0
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50099492 (2-(4-{2-[1-(4-Cyclohexyl-butyl)-3-(4-methyl-3-nitr...) Show SMILES Cc1ccc(NC(=O)N(CCCCC2CCCCC2)CCc2ccc(SC(C)(C)C(O)=O)cc2)cc1[N+]([O-])=O Show InChI InChI=1S/C30H41N3O5S/c1-22-12-15-25(21-27(22)33(37)38)31-29(36)32(19-8-7-11-23-9-5-4-6-10-23)20-18-24-13-16-26(17-14-24)39-30(2,3)28(34)35/h12-17,21,23H,4-11,18-20H2,1-3H3,(H,31,36)(H,34,35)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description In vitro transcriptional activation in CV-1 cells expressing human Gal4-PPAR delta ligand binding domain				Bioorg Med Chem Lett 11: 1225-7 (2001) BindingDB Entry DOI: 10.7270/Q2Z31XX0
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50099491 (2-(4-(2-(3-cyclohexyl-1-(4-cyclohexylbutyl)ureido)...) Show SMILES CC(C)(Sc1ccc(CCN(CCCCC2CCCCC2)C(=O)NC2CCCCC2)cc1)C(O)=O Show InChI InChI=1S/C29H46N2O3S/c1-29(2,27(32)33)35-26-18-16-24(17-19-26)20-22-31(28(34)30-25-14-7-4-8-15-25)21-10-9-13-23-11-5-3-6-12-23/h16-19,23,25H,3-15,20-22H2,1-2H3,(H,30,34)(H,32,33)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Patents Similars	PDB PubMed	n/a	n/a	n/a	n/a	6	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description In vitro transcriptional activation in CV-1 cells expressing human Gal4-PPAR alpha ligand binding domain				Bioorg Med Chem Lett 11: 1225-7 (2001) BindingDB Entry DOI: 10.7270/Q2Z31XX0
					More data for this Ligand-Target Pair				3D Structure (crystal)
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50099493 (2-(4-{2-[1-(2-Biphenyl-4-yl-ethyl)-3-(2,4,5-trimet...) Show SMILES Cc1cc(C)c(NC(=O)N(CCc2ccc(SC(C)(C)C(O)=O)cc2)CCc2ccc(cc2)-c2ccccc2)cc1C Show InChI InChI=1S/C36H40N2O3S/c1-25-23-27(3)33(24-26(25)2)37-35(41)38(21-19-28-11-15-31(16-12-28)30-9-7-6-8-10-30)22-20-29-13-17-32(18-14-29)42-36(4,5)34(39)40/h6-18,23-24H,19-22H2,1-5H3,(H,37,41)(H,39,40)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description In vitro transcriptional activation in CV-1 cells expressing human Gal4-PPAR delta ligand binding domain				Bioorg Med Chem Lett 11: 1225-7 (2001) BindingDB Entry DOI: 10.7270/Q2Z31XX0
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50099486 (2-(4-{2-[1-(2-Biphenyl-4-yl-ethyl)-3-(3,5-dichloro...) Show SMILES CC(C)(Sc1ccc(CCN(CCc2ccc(cc2)-c2ccccc2)C(=O)Nc2cc(Cl)cc(Cl)c2)cc1)C(O)=O Show InChI InChI=1S/C33H32Cl2N2O3S/c1-33(2,31(38)39)41-30-14-10-24(11-15-30)17-19-37(32(40)36-29-21-27(34)20-28(35)22-29)18-16-23-8-12-26(13-9-23)25-6-4-3-5-7-25/h3-15,20-22H,16-19H2,1-2H3,(H,36,40)(H,38,39)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	50	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description In vitro transcriptional activation in CV-1 cells expressing human Gal4-PPAR alpha ligand binding domain				Bioorg Med Chem Lett 11: 1225-7 (2001) BindingDB Entry DOI: 10.7270/Q2Z31XX0
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50099489 (2-(4-{2-[1-(4-Cyclohexyl-butyl)-3-(2-methoxy-pheny...) Show SMILES COc1ccccc1NC(=O)N(CCCCC1CCCCC1)CCc1ccc(SC(C)(C)C(O)=O)cc1 Show InChI InChI=1S/C30H42N2O4S/c1-30(2,28(33)34)37-25-18-16-24(17-19-25)20-22-32(21-10-9-13-23-11-5-4-6-12-23)29(35)31-26-14-7-8-15-27(26)36-3/h7-8,14-19,23H,4-6,9-13,20-22H2,1-3H3,(H,31,35)(H,33,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description In vitro transcriptional activation in CV-1 cells expressing human Gal4-PPAR delta ligand binding domain				Bioorg Med Chem Lett 11: 1225-7 (2001) BindingDB Entry DOI: 10.7270/Q2Z31XX0
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50099492 (2-(4-{2-[1-(4-Cyclohexyl-butyl)-3-(4-methyl-3-nitr...) Show SMILES Cc1ccc(NC(=O)N(CCCCC2CCCCC2)CCc2ccc(SC(C)(C)C(O)=O)cc2)cc1[N+]([O-])=O Show InChI InChI=1S/C30H41N3O5S/c1-22-12-15-25(21-27(22)33(37)38)31-29(36)32(19-8-7-11-23-9-5-4-6-10-23)20-18-24-13-16-26(17-14-24)39-30(2,3)28(34)35/h12-17,21,23H,4-11,18-20H2,1-3H3,(H,31,36)(H,34,35)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	n/a	n/a	20	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description In vitro transcriptional activation in CV-1 cells expressing human Gal4-PPAR alpha ligand binding domain				Bioorg Med Chem Lett 11: 1225-7 (2001) BindingDB Entry DOI: 10.7270/Q2Z31XX0
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50099494 (2-(4-{2-[1-(4-Cyclohexyl-butyl)-3-(3,5-dichloro-ph...) Show SMILES CC(C)(Sc1ccc(CCN(CCCCC2CCCCC2)C(=O)Nc2cc(Cl)cc(Cl)c2)cc1)C(O)=O Show InChI InChI=1S/C29H38Cl2N2O3S/c1-29(2,27(34)35)37-26-13-11-22(12-14-26)15-17-33(16-7-6-10-21-8-4-3-5-9-21)28(36)32-25-19-23(30)18-24(31)20-25/h11-14,18-21H,3-10,15-17H2,1-2H3,(H,32,36)(H,34,35)	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	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description In vitro transcriptional activation in CV-1 cells expressing human Gal4-PPAR gamma ligand binding domain				Bioorg Med Chem Lett 11: 1225-7 (2001) BindingDB Entry DOI: 10.7270/Q2Z31XX0
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50099494 (2-(4-{2-[1-(4-Cyclohexyl-butyl)-3-(3,5-dichloro-ph...) Show SMILES CC(C)(Sc1ccc(CCN(CCCCC2CCCCC2)C(=O)Nc2cc(Cl)cc(Cl)c2)cc1)C(O)=O Show InChI InChI=1S/C29H38Cl2N2O3S/c1-29(2,27(34)35)37-26-13-11-22(12-14-26)15-17-33(16-7-6-10-21-8-4-3-5-9-21)28(36)32-25-19-23(30)18-24(31)20-25/h11-14,18-21H,3-10,15-17H2,1-2H3,(H,32,36)(H,34,35)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	1	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description In vitro transcriptional activation in CV-1 cells expressing human Gal4-PPAR alpha ligand binding domain				Bioorg Med Chem Lett 11: 1225-7 (2001) BindingDB Entry DOI: 10.7270/Q2Z31XX0
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50099489 (2-(4-{2-[1-(4-Cyclohexyl-butyl)-3-(2-methoxy-pheny...) Show SMILES COc1ccccc1NC(=O)N(CCCCC1CCCCC1)CCc1ccc(SC(C)(C)C(O)=O)cc1 Show InChI InChI=1S/C30H42N2O4S/c1-30(2,28(33)34)37-25-18-16-24(17-19-25)20-22-32(21-10-9-13-23-11-5-4-6-12-23)29(35)31-26-14-7-8-15-27(26)36-3/h7-8,14-19,23H,4-6,9-13,20-22H2,1-3H3,(H,31,35)(H,33,34)	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	n/a	n/a	320	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description In vitro transcriptional activation in CV-1 cells expressing human Gal4-PPAR gamma ligand binding domain				Bioorg Med Chem Lett 11: 1225-7 (2001) BindingDB Entry DOI: 10.7270/Q2Z31XX0
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50099486 (2-(4-{2-[1-(2-Biphenyl-4-yl-ethyl)-3-(3,5-dichloro...) Show SMILES CC(C)(Sc1ccc(CCN(CCc2ccc(cc2)-c2ccccc2)C(=O)Nc2cc(Cl)cc(Cl)c2)cc1)C(O)=O Show InChI InChI=1S/C33H32Cl2N2O3S/c1-33(2,31(38)39)41-30-14-10-24(11-15-30)17-19-37(32(40)36-29-21-27(34)20-28(35)22-29)18-16-23-8-12-26(13-9-23)25-6-4-3-5-7-25/h3-15,20-22H,16-19H2,1-2H3,(H,36,40)(H,38,39)	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	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description In vitro transcriptional activation in CV-1 cells expressing human Gal4-PPAR gamma ligand binding domain				Bioorg Med Chem Lett 11: 1225-7 (2001) BindingDB Entry DOI: 10.7270/Q2Z31XX0
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50099494 (2-(4-{2-[1-(4-Cyclohexyl-butyl)-3-(3,5-dichloro-ph...) Show SMILES CC(C)(Sc1ccc(CCN(CCCCC2CCCCC2)C(=O)Nc2cc(Cl)cc(Cl)c2)cc1)C(O)=O Show InChI InChI=1S/C29H38Cl2N2O3S/c1-29(2,27(34)35)37-26-13-11-22(12-14-26)15-17-33(16-7-6-10-21-8-4-3-5-9-21)28(36)32-25-19-23(30)18-24(31)20-25/h11-14,18-21H,3-10,15-17H2,1-2H3,(H,32,36)(H,34,35)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description In vitro transcriptional activation in CV-1 cells expressing human Gal4-PPAR delta ligand binding domain				Bioorg Med Chem Lett 11: 1225-7 (2001) BindingDB Entry DOI: 10.7270/Q2Z31XX0
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM28799 (2-{[4-(2-{[(2,4-difluorophenyl)carbamoyl](heptyl)a...) Show SMILES CCCCCCCN(CCc1ccc(SC(C)(C)C(O)=O)cc1)C(=O)Nc1ccc(F)cc1F Show InChI InChI=1S/C26H34F2N2O3S/c1-4-5-6-7-8-16-30(25(33)29-23-14-11-20(27)18-22(23)28)17-15-19-9-12-21(13-10-19)34-26(2,3)24(31)32/h9-14,18H,4-8,15-17H2,1-3H3,(H,29,33)(H,31,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	n/a	n/a	50	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description In vitro transcriptional activation in CV-1 cells expressing human Gal4-PPAR alpha ligand binding domain				Bioorg Med Chem Lett 11: 1225-7 (2001) BindingDB Entry DOI: 10.7270/Q2Z31XX0
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50099493 (2-(4-{2-[1-(2-Biphenyl-4-yl-ethyl)-3-(2,4,5-trimet...) Show SMILES Cc1cc(C)c(NC(=O)N(CCc2ccc(SC(C)(C)C(O)=O)cc2)CCc2ccc(cc2)-c2ccccc2)cc1C Show InChI InChI=1S/C36H40N2O3S/c1-25-23-27(3)33(24-26(25)2)37-35(41)38(21-19-28-11-15-31(16-12-28)30-9-7-6-8-10-30)22-20-29-13-17-32(18-14-29)42-36(4,5)34(39)40/h6-18,23-24H,19-22H2,1-5H3,(H,37,41)(H,39,40)	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	n/a	n/a	1.35E+3	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description In vitro transcriptional activation in CV-1 cells expressing human Gal4-PPAR gamma ligand binding domain				Bioorg Med Chem Lett 11: 1225-7 (2001) BindingDB Entry DOI: 10.7270/Q2Z31XX0
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50099484 (2-(4-{2-[1-(2-Biphenyl-4-yl-ethyl)-3-(2,4-dimethox...) Show SMILES COc1ccc(NC(=O)N(CCc2ccc(SC(C)(C)C(O)=O)cc2)CCc2ccc(cc2)-c2ccccc2)c(OC)c1 Show InChI InChI=1S/C35H38N2O5S/c1-35(2,33(38)39)43-30-17-12-26(13-18-30)21-23-37(34(40)36-31-19-16-29(41-3)24-32(31)42-4)22-20-25-10-14-28(15-11-25)27-8-6-5-7-9-27/h5-19,24H,20-23H2,1-4H3,(H,36,40)(H,38,39)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	6	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description In vitro transcriptional activation in CV-1 cells expressing human Gal4-PPAR alpha ligand binding domain				Bioorg Med Chem Lett 11: 1225-7 (2001) BindingDB Entry DOI: 10.7270/Q2Z31XX0
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50099493 (2-(4-{2-[1-(2-Biphenyl-4-yl-ethyl)-3-(2,4,5-trimet...) Show SMILES Cc1cc(C)c(NC(=O)N(CCc2ccc(SC(C)(C)C(O)=O)cc2)CCc2ccc(cc2)-c2ccccc2)cc1C Show InChI InChI=1S/C36H40N2O3S/c1-25-23-27(3)33(24-26(25)2)37-35(41)38(21-19-28-11-15-31(16-12-28)30-9-7-6-8-10-30)22-20-29-13-17-32(18-14-29)42-36(4,5)34(39)40/h6-18,23-24H,19-22H2,1-5H3,(H,37,41)(H,39,40)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	9	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description In vitro transcriptional activation in CV-1 cells expressing human Gal4-PPAR alpha ligand binding domain				Bioorg Med Chem Lett 11: 1225-7 (2001) BindingDB Entry DOI: 10.7270/Q2Z31XX0
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50099488 (2-(4-{2-[3-(3-Cyano-phenyl)-1-(4-cyclohexyl-butyl)...) Show SMILES CC(C)(Sc1ccc(CCN(CCCCC2CCCCC2)C(=O)Nc2cccc(c2)C#N)cc1)C(O)=O Show InChI InChI=1S/C30H39N3O3S/c1-30(2,28(34)35)37-27-16-14-24(15-17-27)18-20-33(19-7-6-11-23-9-4-3-5-10-23)29(36)32-26-13-8-12-25(21-26)22-31/h8,12-17,21,23H,3-7,9-11,18-20H2,1-2H3,(H,32,36)(H,34,35)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description In vitro transcriptional activation in CV-1 cells expressing human Gal4-PPAR delta ligand binding domain				Bioorg Med Chem Lett 11: 1225-7 (2001) BindingDB Entry DOI: 10.7270/Q2Z31XX0
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Mus musculus)	BDBM50099491 (2-(4-(2-(3-cyclohexyl-1-(4-cyclohexylbutyl)ureido)...) Show SMILES CC(C)(Sc1ccc(CCN(CCCCC2CCCCC2)C(=O)NC2CCCCC2)cc1)C(O)=O Show InChI InChI=1S/C29H46N2O3S/c1-29(2,27(32)33)35-26-18-16-24(17-19-26)20-22-31(28(34)30-25-14-7-4-8-15-25)21-10-9-13-23-11-5-3-6-12-23/h16-19,23,25H,3-15,20-22H2,1-2H3,(H,30,34)(H,32,33)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Patents Similars	PubMed	n/a	n/a	n/a	n/a	2.90E+3	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Activation of murine PPAR delta ligand binding domain				Bioorg Med Chem Lett 11: 1225-7 (2001) BindingDB Entry DOI: 10.7270/Q2Z31XX0
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50106106 (2-(3-{3-[(3,4-Bis-trifluoromethyl-benzoyl)-(2-cycl...) Show SMILES CC(C)(Oc1cccc(CCCN(C(=O)c2ccc(c(c2)C(F)(F)F)C(F)(F)F)c2cccc(-c3ncon3)c2C2CC2)c1)C(O)=O Show InChI InChI=1S/C33H29F6N3O5/c1-31(2,30(44)45)47-22-8-3-6-19(16-22)7-5-15-42(26-10-4-9-23(27(26)20-11-12-20)28-40-18-46-41-28)29(43)21-13-14-24(32(34,35)36)25(17-21)33(37,38)39/h3-4,6,8-10,13-14,16-18,20H,5,7,11-12,15H2,1-2H3,(H,44,45)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Agonistic transcriptional activity in CV-1 cells expressing Gal4-PPAR delta chimera				Bioorg Med Chem Lett 11: 2959-62 (2001) BindingDB Entry DOI: 10.7270/Q2V69HWQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50106104 (2-[3-(3-{(2-Cyclopropyl-3-[1,2,4]oxadiazol-3-yl-ph...) Show SMILES CC(C)(Oc1cccc(CCCN(C(=O)COc2ccc(Cl)c(Cl)c2)c2cccc(-c3ncon3)c2C2CC2)c1)C(O)=O Show InChI InChI=1S/C32H31Cl2N3O6/c1-32(2,31(39)40)43-23-8-3-6-20(16-23)7-5-15-37(28(38)18-41-22-13-14-25(33)26(34)17-22)27-10-4-9-24(29(27)21-11-12-21)30-35-19-42-36-30/h3-4,6,8-10,13-14,16-17,19,21H,5,7,11-12,15,18H2,1-2H3,(H,39,40)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Agonistic transcriptional activity in CV-1 cells expressing Gal4-PPAR delta chimera				Bioorg Med Chem Lett 11: 2959-62 (2001) BindingDB Entry DOI: 10.7270/Q2V69HWQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Mus musculus)	BDBM50106105 (2-[3-(3-{(2,4-Bis-trifluoromethyl-benzyl)-[2-(4-tr...) Show SMILES CC(C)(Oc1cccc(CCCN(Cc2ccc(cc2C(F)(F)F)C(F)(F)F)C(=O)Cc2ccc(cc2)C(F)(F)F)c1)C(O)=O Show InChI InChI=1S/C31H28F9NO4/c1-28(2,27(43)44)45-24-7-3-5-19(15-24)6-4-14-41(26(42)16-20-8-11-22(12-9-20)29(32,33)34)18-21-10-13-23(30(35,36)37)17-25(21)31(38,39)40/h3,5,7-13,15,17H,4,6,14,16,18H2,1-2H3,(H,43,44)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	n/a	n/a	28	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Agonist activity against PPAR gamma				Bioorg Med Chem Lett 11: 2959-62 (2001) BindingDB Entry DOI: 10.7270/Q2V69HWQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50106105 (2-[3-(3-{(2,4-Bis-trifluoromethyl-benzyl)-[2-(4-tr...) Show SMILES CC(C)(Oc1cccc(CCCN(Cc2ccc(cc2C(F)(F)F)C(F)(F)F)C(=O)Cc2ccc(cc2)C(F)(F)F)c1)C(O)=O Show InChI InChI=1S/C31H28F9NO4/c1-28(2,27(43)44)45-24-7-3-5-19(15-24)6-4-14-41(26(42)16-20-8-11-22(12-9-20)29(32,33)34)18-21-10-13-23(30(35,36)37)17-25(21)31(38,39)40/h3,5,7-13,15,17H,4,6,14,16,18H2,1-2H3,(H,43,44)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	n/a	n/a	4	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Agonistic transcriptional activity in CV-1 cells expressing Gal4-PPAR gamma chimera				Bioorg Med Chem Lett 11: 2959-62 (2001) BindingDB Entry DOI: 10.7270/Q2V69HWQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50106107 (2-[3-(3-{(2-Cyclopropyl-3-[1,2,4]oxadiazol-3-yl-ph...) Show SMILES CC(C)(Oc1cccc(CCCN(C(=O)Cc2ccc(cc2)C(F)(F)F)c2cccc(-c3ncon3)c2C2CC2)c1)C(O)=O Show InChI InChI=1S/C33H32F3N3O5/c1-32(2,31(41)42)44-25-8-3-6-21(18-25)7-5-17-39(28(40)19-22-11-15-24(16-12-22)33(34,35)36)27-10-4-9-26(29(27)23-13-14-23)30-37-20-43-38-30/h3-4,6,8-12,15-16,18,20,23H,5,7,13-14,17,19H2,1-2H3,(H,41,42)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	620	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Agonistic transcriptional activity in CV-1 cells expressing Gal4-PPAR alpha chimera				Bioorg Med Chem Lett 11: 2959-62 (2001) BindingDB Entry DOI: 10.7270/Q2V69HWQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50106105 (2-[3-(3-{(2,4-Bis-trifluoromethyl-benzyl)-[2-(4-tr...) Show SMILES CC(C)(Oc1cccc(CCCN(Cc2ccc(cc2C(F)(F)F)C(F)(F)F)C(=O)Cc2ccc(cc2)C(F)(F)F)c1)C(O)=O Show InChI InChI=1S/C31H28F9NO4/c1-28(2,27(43)44)45-24-7-3-5-19(15-24)6-4-14-41(26(42)16-20-8-11-22(12-9-20)29(32,33)34)18-21-10-13-23(30(35,36)37)17-25(21)31(38,39)40/h3,5,7-13,15,17H,4,6,14,16,18H2,1-2H3,(H,43,44)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	n/a	n/a	620	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Agonistic transcriptional activity in CV-1 cells expressing Gal4-PPAR alpha chimera				Bioorg Med Chem Lett 11: 2959-62 (2001) BindingDB Entry DOI: 10.7270/Q2V69HWQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50106108 (2-[3-(3-{(2,4-Bis-trifluoromethyl-benzyl)-[2-(3,4-...) Show SMILES CC(C)(Oc1cccc(CCCN(Cc2ccc(cc2C(F)(F)F)C(F)(F)F)C(=O)COc2ccc(Cl)c(Cl)c2)c1)C(O)=O Show InChI InChI=1S/C30H27Cl2F6NO5/c1-28(2,27(41)42)44-22-7-3-5-18(13-22)6-4-12-39(26(40)17-43-21-10-11-24(31)25(32)15-21)16-19-8-9-20(29(33,34)35)14-23(19)30(36,37)38/h3,5,7-11,13-15H,4,6,12,16-17H2,1-2H3,(H,41,42)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	n/a	n/a	710	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Agonistic transcriptional activity in CV-1 cells expressing Gal4-PPAR alpha chimera				Bioorg Med Chem Lett 11: 2959-62 (2001) BindingDB Entry DOI: 10.7270/Q2V69HWQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50106104 (2-[3-(3-{(2-Cyclopropyl-3-[1,2,4]oxadiazol-3-yl-ph...) Show SMILES CC(C)(Oc1cccc(CCCN(C(=O)COc2ccc(Cl)c(Cl)c2)c2cccc(-c3ncon3)c2C2CC2)c1)C(O)=O Show InChI InChI=1S/C32H31Cl2N3O6/c1-32(2,31(39)40)43-23-8-3-6-20(16-23)7-5-15-37(28(38)18-41-22-13-14-25(33)26(34)17-22)27-10-4-9-24(29(27)21-11-12-21)30-35-19-42-36-30/h3-4,6,8-10,13-14,16-17,19,21H,5,7,11-12,15,18H2,1-2H3,(H,39,40)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	n/a	n/a	170	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Agonistic transcriptional activity in CV-1 cells expressing Gal4-PPAR gamma chimera				Bioorg Med Chem Lett 11: 2959-62 (2001) BindingDB Entry DOI: 10.7270/Q2V69HWQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50106104 (2-[3-(3-{(2-Cyclopropyl-3-[1,2,4]oxadiazol-3-yl-ph...) Show SMILES CC(C)(Oc1cccc(CCCN(C(=O)COc2ccc(Cl)c(Cl)c2)c2cccc(-c3ncon3)c2C2CC2)c1)C(O)=O Show InChI InChI=1S/C32H31Cl2N3O6/c1-32(2,31(39)40)43-23-8-3-6-20(16-23)7-5-15-37(28(38)18-41-22-13-14-25(33)26(34)17-22)27-10-4-9-24(29(27)21-11-12-21)30-35-19-42-36-30/h3-4,6,8-10,13-14,16-17,19,21H,5,7,11-12,15,18H2,1-2H3,(H,39,40)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	n/a	n/a	230	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Agonistic transcriptional activity in CV-1 cells expressing Gal4-PPAR alpha chimera				Bioorg Med Chem Lett 11: 2959-62 (2001) BindingDB Entry DOI: 10.7270/Q2V69HWQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Mus musculus)	BDBM50106105 (2-[3-(3-{(2,4-Bis-trifluoromethyl-benzyl)-[2-(4-tr...) Show SMILES CC(C)(Oc1cccc(CCCN(Cc2ccc(cc2C(F)(F)F)C(F)(F)F)C(=O)Cc2ccc(cc2)C(F)(F)F)c1)C(O)=O Show InChI InChI=1S/C31H28F9NO4/c1-28(2,27(43)44)45-24-7-3-5-19(15-24)6-4-14-41(26(42)16-20-8-11-22(12-9-20)29(32,33)34)18-21-10-13-23(30(35,36)37)17-25(21)31(38,39)40/h3,5,7-13,15,17H,4,6,14,16,18H2,1-2H3,(H,43,44)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	n/a	n/a	19	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Agonist activity against PPAR delta				Bioorg Med Chem Lett 11: 2959-62 (2001) BindingDB Entry DOI: 10.7270/Q2V69HWQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50106106 (2-(3-{3-[(3,4-Bis-trifluoromethyl-benzoyl)-(2-cycl...) Show SMILES CC(C)(Oc1cccc(CCCN(C(=O)c2ccc(c(c2)C(F)(F)F)C(F)(F)F)c2cccc(-c3ncon3)c2C2CC2)c1)C(O)=O Show InChI InChI=1S/C33H29F6N3O5/c1-31(2,30(44)45)47-22-8-3-6-19(16-22)7-5-15-42(26-10-4-9-23(27(26)20-11-12-20)28-40-18-46-41-28)29(43)21-13-14-24(32(34,35)36)25(17-21)33(37,38)39/h3-4,6,8-10,13-14,16-18,20H,5,7,11-12,15H2,1-2H3,(H,44,45)	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	n/a	n/a	320	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Agonistic transcriptional activity in CV-1 cells expressing Gal4-PPAR gamma chimera				Bioorg Med Chem Lett 11: 2959-62 (2001) BindingDB Entry DOI: 10.7270/Q2V69HWQ
					More data for this Ligand-Target Pair

Displayed 1 to 50 (of 63 total )  |  Next  |  Last  >>

Jump to: