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Compile Data Set for Download or QSAR

Found 425 hits with Last Name = 'cuc ngo' and Initial = 'c'   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50312445
PNG
(2-(4-((4-(4-(Methylsulfonamide)phenyl)-5-(4-(trifl...)
Show SMILES Cc1cc(OCc2nc(c(s2)-c2ccc(OC(F)(F)F)cc2)-c2ccc(NS(C)(=O)=O)cc2)ccc1OCC(O)=O
Show InChI InChI=1S/C27H23F3N2O7S2/c1-16-13-21(11-12-22(16)38-15-24(33)34)37-14-23-31-25(17-3-7-19(8-4-17)32-41(2,35)36)26(40-23)18-5-9-20(10-6-18)39-27(28,29)30/h3-13,32H,14-15H2,1-2H3,(H,33,34)
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n/an/an/an/a 775n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARdelta ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50312422
PNG
(2-(4-((4-(4-(Cyclopentyloxy)phenyl)-5-(4-(trifluor...)
Show SMILES Cc1cc(OCc2nc(c(o2)-c2ccc(OC(F)(F)F)cc2)-c2ccc(OC3CCCC3)cc2)ccc1OCC(O)=O
Show InChI InChI=1S/C31H28F3NO7/c1-19-16-25(14-15-26(19)39-18-28(36)37)38-17-27-35-29(20-6-10-23(11-7-20)40-22-4-2-3-5-22)30(41-27)21-8-12-24(13-9-21)42-31(32,33)34/h6-16,22H,2-5,17-18H2,1H3,(H,36,37)
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n/an/an/an/a 910n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50312429
PNG
(2-(4-((4-(4-(Piperidin-1-yl)phenyl)-5-(4-(trifluor...)
Show SMILES Cc1cc(OCc2nc(c(o2)-c2ccc(OC(F)(F)F)cc2)-c2ccc(cc2)C(=O)N2CCCCC2)ccc1OCC(O)=O
Show InChI InChI=1S/C32H29F3N2O7/c1-20-17-25(13-14-26(20)42-19-28(38)39)41-18-27-36-29(30(43-27)22-9-11-24(12-10-22)44-32(33,34)35)21-5-7-23(8-6-21)31(40)37-15-3-2-4-16-37/h5-14,17H,2-4,15-16,18-19H2,1H3,(H,38,39)
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n/an/an/an/a 1.15E+3n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50312420
PNG
(2-(4-((4-(4-(N-Isopropyl-N-methyl)benzamide)-5-(4-...)
Show SMILES CC(C)N(C)C(=O)c1ccc(cc1)-c1nc(COc2ccc(OCC(O)=O)c(C)c2)sc1-c1ccc(OC(F)(F)F)cc1
Show InChI InChI=1S/C31H29F3N2O6S/c1-18(2)36(4)30(39)22-7-5-20(6-8-22)28-29(21-9-11-23(12-10-21)42-31(32,33)34)43-26(35-28)16-40-24-13-14-25(19(3)15-24)41-17-27(37)38/h5-15,18H,16-17H2,1-4H3,(H,37,38)
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n/an/an/an/a 1.20E+3n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50312423
PNG
(2-(4-((4-(4-((Piperidin-1-yl)methanone)phenyl)-5-(...)
Show SMILES Cc1cc(OCc2nc(c(s2)-c2ccc(OC(F)(F)F)cc2)-c2ccc(cc2)C(=O)N2CCCCC2)ccc1OCC(O)=O
Show InChI InChI=1S/C32H29F3N2O6S/c1-20-17-25(13-14-26(20)42-19-28(38)39)41-18-27-36-29(30(44-27)22-9-11-24(12-10-22)43-32(33,34)35)21-5-7-23(8-6-21)31(40)37-15-3-2-4-16-37/h5-14,17H,2-4,15-16,18-19H2,1H3,(H,38,39)
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n/an/an/an/a 1.56E+3n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50312423
PNG
(2-(4-((4-(4-((Piperidin-1-yl)methanone)phenyl)-5-(...)
Show SMILES Cc1cc(OCc2nc(c(s2)-c2ccc(OC(F)(F)F)cc2)-c2ccc(cc2)C(=O)N2CCCCC2)ccc1OCC(O)=O
Show InChI InChI=1S/C32H29F3N2O6S/c1-20-17-25(13-14-26(20)42-19-28(38)39)41-18-27-36-29(30(44-27)22-9-11-24(12-10-22)43-32(33,34)35)21-5-7-23(8-6-21)31(40)37-15-3-2-4-16-37/h5-14,17H,2-4,15-16,18-19H2,1H3,(H,38,39)
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n/an/an/an/a 1.59E+3n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50312421
PNG
(2-(4-((4-(4-Isopropoxyphenyl)-5-(4-(trifluorometho...)
Show SMILES CC(C)Oc1ccc(cc1)-c1nc(COc2ccc(OCC(O)=O)c(C)c2)oc1-c1ccc(OC(F)(F)F)cc1
Show InChI InChI=1S/C29H26F3NO7/c1-17(2)38-21-8-4-19(5-9-21)27-28(20-6-10-22(11-7-20)40-29(30,31)32)39-25(33-27)15-36-23-12-13-24(18(3)14-23)37-16-26(34)35/h4-14,17H,15-16H2,1-3H3,(H,34,35)
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n/an/an/an/a 2.60E+3n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50312437
PNG
(2-(4-((4-(4-(Piperidin-1-yl)phenyl)-5-(4-(trifluor...)
Show SMILES Cc1cc(OCc2nc(c(s2)-c2ccc(OC(F)(F)F)cc2)-c2ccc(cc2)N2CCCCC2)ccc1OCC(O)=O
Show InChI InChI=1S/C31H29F3N2O5S/c1-20-17-25(13-14-26(20)40-19-28(37)38)39-18-27-35-29(21-5-9-23(10-6-21)36-15-3-2-4-16-36)30(42-27)22-7-11-24(12-8-22)41-31(32,33)34/h5-14,17H,2-4,15-16,18-19H2,1H3,(H,37,38)
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n/an/an/an/a 5.20E+3n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50312446
PNG
(CHEMBL1081951 | {4-[4,5-Bis(4-methoxyphenyl)thiazo...)
Show SMILES COc1ccc(cc1)-c1nc(SCc2ccc(OCC(O)=O)c(C)c2)sc1-c1ccc(OC)cc1
Show InChI InChI=1S/C27H25NO5S2/c1-17-14-18(4-13-23(17)33-15-24(29)30)16-34-27-28-25(19-5-9-21(31-2)10-6-19)26(35-27)20-7-11-22(32-3)12-8-20/h4-14H,15-16H2,1-3H3,(H,29,30)
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n/an/an/an/a>1.00E+4n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50312447
PNG
(CHEMBL1080187 | {4-[4,5-Bis(4-methoxyphenyl)thiazo...)
Show SMILES COc1ccc(cc1)-c1nc(Sc2ccc(OCC(O)=O)c(C)c2)sc1-c1ccc(OC)cc1
Show InChI InChI=1S/C26H23NO5S2/c1-16-14-21(12-13-22(16)32-15-23(28)29)33-26-27-24(17-4-8-19(30-2)9-5-17)25(34-26)18-6-10-20(31-3)11-7-18/h4-14H,15H2,1-3H3,(H,28,29)
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n/an/an/an/a>1.00E+4n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50312448
PNG
(CHEMBL1081964 | {4-[4,5-Bis(4-methoxyphenyl)thiazo...)
Show SMILES COc1ccc(cc1)-c1nc(COc2ccc(OCC(O)=O)c(C)c2)sc1-c1ccc(OC)cc1
Show InChI InChI=1S/C27H25NO6S/c1-17-14-22(12-13-23(17)34-16-25(29)30)33-15-24-28-26(18-4-8-20(31-2)9-5-18)27(35-24)19-6-10-21(32-3)11-7-19/h4-14H,15-16H2,1-3H3,(H,29,30)
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n/an/an/an/a>1.00E+4n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50312449
PNG
(2-(4-((4,5-Bis(4-methoxyphenyl)thiazol-2-yl)methyl...)
Show SMILES COc1ccc(cc1)-c1nc(CSc2ccc(OCC(O)=O)c(C)c2)sc1-c1ccc(OC)cc1
Show InChI InChI=1S/C27H25NO5S2/c1-17-14-22(12-13-23(17)33-15-25(29)30)34-16-24-28-26(18-4-8-20(31-2)9-5-18)27(35-24)19-6-10-21(32-3)11-7-19/h4-14H,15-16H2,1-3H3,(H,29,30)
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n/an/an/an/a>1.00E+4n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50312450
PNG
(CHEMBL1080363 | {4-[4,5-Bis(4-methoxyphenyl)oxazol...)
Show SMILES COc1ccc(cc1)-c1nc(COc2ccc(OCC(O)=O)c(C)c2)oc1-c1ccc(OC)cc1
Show InChI InChI=1S/C27H25NO7/c1-17-14-22(12-13-23(17)34-16-25(29)30)33-15-24-28-26(18-4-8-20(31-2)9-5-18)27(35-24)19-6-10-21(32-3)11-7-19/h4-14H,15-16H2,1-3H3,(H,29,30)
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n/an/an/an/a>1.00E+4n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50312451
PNG
(2-(4-((4,5-Bis(4-methoxyphenyl)oxazol-2-yl)methylt...)
Show SMILES COc1ccc(cc1)-c1nc(CSc2ccc(OCC(O)=O)c(C)c2)oc1-c1ccc(OC)cc1
Show InChI InChI=1S/C27H25NO6S/c1-17-14-22(12-13-23(17)33-15-25(29)30)35-16-24-28-26(18-4-8-20(31-2)9-5-18)27(34-24)19-6-10-21(32-3)11-7-19/h4-14H,15-16H2,1-3H3,(H,29,30)
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n/an/an/an/a>1.00E+4n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50312452
PNG
(2-(4-((4,5-Bis(4-methoxyphenyl)thiazol-2-ylthio)me...)
Show SMILES COc1ccc(cc1)-c1nc(SCc2ccc(OCC(O)=O)cc2Cl)sc1-c1ccc(OC)cc1
Show InChI InChI=1S/C26H22ClNO5S2/c1-31-19-8-3-16(4-9-19)24-25(17-5-10-20(32-2)11-6-17)35-26(28-24)34-15-18-7-12-21(13-22(18)27)33-14-23(29)30/h3-13H,14-15H2,1-2H3,(H,29,30)
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n/an/an/an/a>1.00E+4n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50312453
PNG
(2-(4-(4,5-Bis(4-methoxyphenyl)thiazol-2-ylthio)-3-...)
Show SMILES COc1ccc(cc1)-c1nc(Sc2ccc(OCC(O)=O)cc2Cl)sc1-c1ccc(OC)cc1
Show InChI InChI=1S/C25H20ClNO5S2/c1-30-17-7-3-15(4-8-17)23-24(16-5-9-18(31-2)10-6-16)34-25(27-23)33-21-12-11-19(13-20(21)26)32-14-22(28)29/h3-13H,14H2,1-2H3,(H,28,29)
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n/an/an/an/a>1.00E+4n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50312454
PNG
(2-(4-((4,5-Bis(4-methoxyphenyl)thiazol-2-yl)methox...)
Show SMILES COc1ccc(cc1)-c1nc(COc2ccc(OCC(O)=O)cc2Cl)sc1-c1ccc(OC)cc1
Show InChI InChI=1S/C26H22ClNO6S/c1-31-18-7-3-16(4-8-18)25-26(17-5-9-19(32-2)10-6-17)35-23(28-25)14-34-22-12-11-20(13-21(22)27)33-15-24(29)30/h3-13H,14-15H2,1-2H3,(H,29,30)
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n/an/an/an/a>1.00E+4n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50312455
PNG
(2-(4-((4,5-Bis(4-methoxyphenyl)thiazol-2-yl)methyl...)
Show SMILES COc1ccc(cc1)-c1nc(CSc2ccc(OCC(O)=O)cc2Cl)sc1-c1ccc(OC)cc1
Show InChI InChI=1S/C26H22ClNO5S2/c1-31-18-7-3-16(4-8-18)25-26(17-5-9-19(32-2)10-6-17)35-23(28-25)15-34-22-12-11-20(13-21(22)27)33-14-24(29)30/h3-13H,14-15H2,1-2H3,(H,29,30)
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n/an/an/an/a>1.00E+4n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50312456
PNG
(2-(4-((4,5-Bis(4-methoxyphenyl)oxazol-2-yl)methylt...)
Show SMILES COc1ccc(cc1)-c1nc(CSc2ccc(OCC(O)=O)cc2Cl)oc1-c1ccc(OC)cc1
Show InChI InChI=1S/C26H22ClNO6S/c1-31-18-7-3-16(4-8-18)25-26(17-5-9-19(32-2)10-6-17)34-23(28-25)15-35-22-12-11-20(13-21(22)27)33-14-24(29)30/h3-13H,14-15H2,1-2H3,(H,29,30)
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n/an/an/an/a>1.00E+4n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50312446
PNG
(CHEMBL1081951 | {4-[4,5-Bis(4-methoxyphenyl)thiazo...)
Show SMILES COc1ccc(cc1)-c1nc(SCc2ccc(OCC(O)=O)c(C)c2)sc1-c1ccc(OC)cc1
Show InChI InChI=1S/C27H25NO5S2/c1-17-14-18(4-13-23(17)33-15-24(29)30)16-34-27-28-25(19-5-9-21(31-2)10-6-19)26(35-27)20-7-11-22(32-3)12-8-20/h4-14H,15-16H2,1-3H3,(H,29,30)
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n/an/an/an/a>1.00E+4n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50312447
PNG
(CHEMBL1080187 | {4-[4,5-Bis(4-methoxyphenyl)thiazo...)
Show SMILES COc1ccc(cc1)-c1nc(Sc2ccc(OCC(O)=O)c(C)c2)sc1-c1ccc(OC)cc1
Show InChI InChI=1S/C26H23NO5S2/c1-16-14-21(12-13-22(16)32-15-23(28)29)33-26-27-24(17-4-8-19(30-2)9-5-17)25(34-26)18-6-10-20(31-3)11-7-18/h4-14H,15H2,1-3H3,(H,28,29)
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n/an/an/an/a>1.00E+4n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50312448
PNG
(CHEMBL1081964 | {4-[4,5-Bis(4-methoxyphenyl)thiazo...)
Show SMILES COc1ccc(cc1)-c1nc(COc2ccc(OCC(O)=O)c(C)c2)sc1-c1ccc(OC)cc1
Show InChI InChI=1S/C27H25NO6S/c1-17-14-22(12-13-23(17)34-16-25(29)30)33-15-24-28-26(18-4-8-20(31-2)9-5-18)27(35-24)19-6-10-21(32-3)11-7-19/h4-14H,15-16H2,1-3H3,(H,29,30)
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n/an/an/an/a>1.00E+4n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50312449
PNG
(2-(4-((4,5-Bis(4-methoxyphenyl)thiazol-2-yl)methyl...)
Show SMILES COc1ccc(cc1)-c1nc(CSc2ccc(OCC(O)=O)c(C)c2)sc1-c1ccc(OC)cc1
Show InChI InChI=1S/C27H25NO5S2/c1-17-14-22(12-13-23(17)33-15-25(29)30)34-16-24-28-26(18-4-8-20(31-2)9-5-18)27(35-24)19-6-10-21(32-3)11-7-19/h4-14H,15-16H2,1-3H3,(H,29,30)
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n/an/an/an/a>1.00E+4n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50312450
PNG
(CHEMBL1080363 | {4-[4,5-Bis(4-methoxyphenyl)oxazol...)
Show SMILES COc1ccc(cc1)-c1nc(COc2ccc(OCC(O)=O)c(C)c2)oc1-c1ccc(OC)cc1
Show InChI InChI=1S/C27H25NO7/c1-17-14-22(12-13-23(17)34-16-25(29)30)33-15-24-28-26(18-4-8-20(31-2)9-5-18)27(35-24)19-6-10-21(32-3)11-7-19/h4-14H,15-16H2,1-3H3,(H,29,30)
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The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50312451
PNG
(2-(4-((4,5-Bis(4-methoxyphenyl)oxazol-2-yl)methylt...)
Show SMILES COc1ccc(cc1)-c1nc(CSc2ccc(OCC(O)=O)c(C)c2)oc1-c1ccc(OC)cc1
Show InChI InChI=1S/C27H25NO6S/c1-17-14-22(12-13-23(17)33-15-25(29)30)35-16-24-28-26(18-4-8-20(31-2)9-5-18)27(34-24)19-6-10-21(32-3)11-7-19/h4-14H,15-16H2,1-3H3,(H,29,30)
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n/an/an/an/a>1.00E+4n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50312452
PNG
(2-(4-((4,5-Bis(4-methoxyphenyl)thiazol-2-ylthio)me...)
Show SMILES COc1ccc(cc1)-c1nc(SCc2ccc(OCC(O)=O)cc2Cl)sc1-c1ccc(OC)cc1
Show InChI InChI=1S/C26H22ClNO5S2/c1-31-19-8-3-16(4-9-19)24-25(17-5-10-20(32-2)11-6-17)35-26(28-24)34-15-18-7-12-21(13-22(18)27)33-14-23(29)30/h3-13H,14-15H2,1-2H3,(H,29,30)
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n/an/an/an/a>1.00E+4n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50312453
PNG
(2-(4-(4,5-Bis(4-methoxyphenyl)thiazol-2-ylthio)-3-...)
Show SMILES COc1ccc(cc1)-c1nc(Sc2ccc(OCC(O)=O)cc2Cl)sc1-c1ccc(OC)cc1
Show InChI InChI=1S/C25H20ClNO5S2/c1-30-17-7-3-15(4-8-17)23-24(16-5-9-18(31-2)10-6-16)34-25(27-23)33-21-12-11-19(13-20(21)26)32-14-22(28)29/h3-13H,14H2,1-2H3,(H,28,29)
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n/an/an/an/a>1.00E+4n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50312454
PNG
(2-(4-((4,5-Bis(4-methoxyphenyl)thiazol-2-yl)methox...)
Show SMILES COc1ccc(cc1)-c1nc(COc2ccc(OCC(O)=O)cc2Cl)sc1-c1ccc(OC)cc1
Show InChI InChI=1S/C26H22ClNO6S/c1-31-18-7-3-16(4-8-18)25-26(17-5-9-19(32-2)10-6-17)35-23(28-25)14-34-22-12-11-20(13-21(22)27)33-15-24(29)30/h3-13H,14-15H2,1-2H3,(H,29,30)
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The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50312455
PNG
(2-(4-((4,5-Bis(4-methoxyphenyl)thiazol-2-yl)methyl...)
Show SMILES COc1ccc(cc1)-c1nc(CSc2ccc(OCC(O)=O)cc2Cl)sc1-c1ccc(OC)cc1
Show InChI InChI=1S/C26H22ClNO5S2/c1-31-18-7-3-16(4-8-18)25-26(17-5-9-19(32-2)10-6-17)35-23(28-25)15-34-22-12-11-20(13-21(22)27)33-14-24(29)30/h3-13H,14-15H2,1-2H3,(H,29,30)
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The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50312456
PNG
(2-(4-((4,5-Bis(4-methoxyphenyl)oxazol-2-yl)methylt...)
Show SMILES COc1ccc(cc1)-c1nc(CSc2ccc(OCC(O)=O)cc2Cl)oc1-c1ccc(OC)cc1
Show InChI InChI=1S/C26H22ClNO6S/c1-31-18-7-3-16(4-8-18)25-26(17-5-9-19(32-2)10-6-17)34-23(28-25)15-35-22-12-11-20(13-21(22)27)33-14-24(29)30/h3-13H,14-15H2,1-2H3,(H,29,30)
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The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50312457
PNG
(2-(4-(4-(4,5-Bis(4-methoxyphenyl)thiazol-2-ylthio)...)
Show SMILES COc1ccc(cc1)-c1nc(SCCCCOc2ccc(OCC(O)=O)c(C)c2)sc1-c1ccc(OC)cc1
Show InChI InChI=1S/C30H31NO6S2/c1-20-18-25(14-15-26(20)37-19-27(32)33)36-16-4-5-17-38-30-31-28(21-6-10-23(34-2)11-7-21)29(39-30)22-8-12-24(35-3)13-9-22/h6-15,18H,4-5,16-17,19H2,1-3H3,(H,32,33)
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The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARdelta ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50312458
PNG
(2-(4-(3-(4,5-Bis(4-methoxyphenyl)thiazol-2-ylthio)...)
Show SMILES COc1ccc(cc1)-c1nc(SCCCOc2ccc(OCC(O)=O)c(C)c2)sc1-c1ccc(OC)cc1
Show InChI InChI=1S/C29H29NO6S2/c1-19-17-24(13-14-25(19)36-18-26(31)32)35-15-4-16-37-29-30-27(20-5-9-22(33-2)10-6-20)28(38-29)21-7-11-23(34-3)12-8-21/h5-14,17H,4,15-16,18H2,1-3H3,(H,31,32)
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The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARdelta ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50312459
PNG
((4-{2-[4,5-Bis(4-methoxyphenyl)thiazol-2-ylsulfany...)
Show SMILES COc1ccc(cc1)-c1nc(SCCOc2ccc(OCC(O)=O)c(C)c2)sc1-c1ccc(OC)cc1
Show InChI InChI=1S/C28H27NO6S2/c1-18-16-23(12-13-24(18)35-17-25(30)31)34-14-15-36-28-29-26(19-4-8-21(32-2)9-5-19)27(37-28)20-6-10-22(33-3)11-7-20/h4-13,16H,14-15,17H2,1-3H3,(H,30,31)
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The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARdelta ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50312460
PNG
(2-(4-(4-(4,5-Bis(4-methoxyphenyl)thiazol-2-ylthio)...)
Show SMILES COc1ccc(cc1)-c1nc(SCCCCOc2ccc(OCC(O)=O)cc2Cl)sc1-c1ccc(OC)cc1
Show InChI InChI=1S/C29H28ClNO6S2/c1-34-21-9-5-19(6-10-21)27-28(20-7-11-22(35-2)12-8-20)39-29(31-27)38-16-4-3-15-36-25-14-13-23(17-24(25)30)37-18-26(32)33/h5-14,17H,3-4,15-16,18H2,1-2H3,(H,32,33)
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The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARdelta ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50312461
PNG
(2-(4-(3-(4,5-Bis(4-methoxyphenyl)thiazol-2-ylthio)...)
Show SMILES COc1ccc(cc1)-c1nc(SCCCOc2ccc(OCC(O)=O)cc2Cl)sc1-c1ccc(OC)cc1
Show InChI InChI=1S/C28H26ClNO6S2/c1-33-20-8-4-18(5-9-20)26-27(19-6-10-21(34-2)11-7-19)38-28(30-26)37-15-3-14-35-24-13-12-22(16-23(24)29)36-17-25(31)32/h4-13,16H,3,14-15,17H2,1-2H3,(H,31,32)
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n/an/an/an/a>1.00E+4n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARdelta ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50312462
PNG
(2-(4-(2-(4,5-Bis(4-methoxyphenyl)thiazol-2-ylthio)...)
Show SMILES COc1ccc(cc1)-c1nc(SCCOc2ccc(OCC(O)=O)cc2Cl)sc1-c1ccc(OC)cc1
Show InChI InChI=1S/C27H24ClNO6S2/c1-32-19-7-3-17(4-8-19)25-26(18-5-9-20(33-2)10-6-18)37-27(29-25)36-14-13-34-23-12-11-21(15-22(23)28)35-16-24(30)31/h3-12,15H,13-14,16H2,1-2H3,(H,30,31)
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n/an/an/an/a>1.00E+4n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARdelta ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50126016
PNG
(2-(3-chloro-4-(3-(3-ethyl-7-propylbenzo[d]isoxazol...)
Show SMILES CCCc1c(OCCCSc2ccc(CC(O)=O)cc2Cl)ccc2c(CC)noc12
Show InChI InChI=1S/C23H26ClNO4S/c1-3-6-17-20(9-8-16-19(4-2)25-29-23(16)17)28-11-5-12-30-21-10-7-15(13-18(21)24)14-22(26)27/h7-10,13H,3-6,11-12,14H2,1-2H3,(H,26,27)
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n/an/an/an/a 1.30E+3n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50126016
PNG
(2-(3-chloro-4-(3-(3-ethyl-7-propylbenzo[d]isoxazol...)
Show SMILES CCCc1c(OCCCSc2ccc(CC(O)=O)cc2Cl)ccc2c(CC)noc12
Show InChI InChI=1S/C23H26ClNO4S/c1-3-6-17-20(9-8-16-19(4-2)25-29-23(16)17)28-11-5-12-30-21-10-7-15(13-18(21)24)14-22(26)27/h7-10,13H,3-6,11-12,14H2,1-2H3,(H,26,27)
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n/an/an/an/a 100n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50126016
PNG
(2-(3-chloro-4-(3-(3-ethyl-7-propylbenzo[d]isoxazol...)
Show SMILES CCCc1c(OCCCSc2ccc(CC(O)=O)cc2Cl)ccc2c(CC)noc12
Show InChI InChI=1S/C23H26ClNO4S/c1-3-6-17-20(9-8-16-19(4-2)25-29-23(16)17)28-11-5-12-30-21-10-7-15(13-18(21)24)14-22(26)27/h7-10,13H,3-6,11-12,14H2,1-2H3,(H,26,27)
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n/an/an/an/a 12n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARdelta ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50312463
PNG
(2-(4-((cyclohexyl(2-(2,4-dichlorophenylamino)-2-ox...)
Show SMILES Cc1cc(CN(CC(=O)Nc2ccc(Cl)cc2Cl)C2CCCCC2)ccc1OCC(O)=O
Show InChI InChI=1S/C24H28Cl2N2O4/c1-16-11-17(7-10-22(16)32-15-24(30)31)13-28(19-5-3-2-4-6-19)14-23(29)27-21-9-8-18(25)12-20(21)26/h7-12,19H,2-6,13-15H2,1H3,(H,27,29)(H,30,31)
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n/an/an/an/a 3n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARdelta ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50312464
PNG
(2-(4-(3-(4-bromophenyl)-5-(4-(trifluoromethyl)phen...)
Show SMILES Cc1cc(OC\C=C(/C#Cc2ccc(cc2)C(F)(F)F)c2ccc(Br)cc2)ccc1OCC(O)=O
Show InChI InChI=1S/C27H20BrF3O4/c1-18-16-24(12-13-25(18)35-17-26(32)33)34-15-14-21(20-6-10-23(28)11-7-20)5-2-19-3-8-22(9-4-19)27(29,30)31/h3-4,6-14,16H,15,17H2,1H3,(H,32,33)/b21-14+
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n/an/an/an/a>1.00E+4n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50312464
PNG
(2-(4-(3-(4-bromophenyl)-5-(4-(trifluoromethyl)phen...)
Show SMILES Cc1cc(OC\C=C(/C#Cc2ccc(cc2)C(F)(F)F)c2ccc(Br)cc2)ccc1OCC(O)=O
Show InChI InChI=1S/C27H20BrF3O4/c1-18-16-24(12-13-25(18)35-17-26(32)33)34-15-14-21(20-6-10-23(28)11-7-20)5-2-19-3-8-22(9-4-19)27(29,30)31/h3-4,6-14,16H,15,17H2,1H3,(H,32,33)/b21-14+
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n/an/an/an/a>1.00E+4n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50312464
PNG
(2-(4-(3-(4-bromophenyl)-5-(4-(trifluoromethyl)phen...)
Show SMILES Cc1cc(OC\C=C(/C#Cc2ccc(cc2)C(F)(F)F)c2ccc(Br)cc2)ccc1OCC(O)=O
Show InChI InChI=1S/C27H20BrF3O4/c1-18-16-24(12-13-25(18)35-17-26(32)33)34-15-14-21(20-6-10-23(28)11-7-20)5-2-19-3-8-22(9-4-19)27(29,30)31/h3-4,6-14,16H,15,17H2,1H3,(H,32,33)/b21-14+
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n/an/an/an/a 130n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARdelta ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50184652
PNG
(CHEMBL210469 | [4-(4,4''-Bis-trifluoromethyl-[1,1'...)
Show SMILES Cc1cc(OCc2cc(cc(c2)-c2ccc(cc2)C(F)(F)F)-c2ccc(cc2)C(F)(F)F)ccc1OCC(O)=O
Show InChI InChI=1S/C30H22F6O4/c1-18-12-26(10-11-27(18)40-17-28(37)38)39-16-19-13-22(20-2-6-24(7-3-20)29(31,32)33)15-23(14-19)21-4-8-25(9-5-21)30(34,35)36/h2-15H,16-17H2,1H3,(H,37,38)
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n/an/an/an/a>1.00E+4n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50184652
PNG
(CHEMBL210469 | [4-(4,4''-Bis-trifluoromethyl-[1,1'...)
Show SMILES Cc1cc(OCc2cc(cc(c2)-c2ccc(cc2)C(F)(F)F)-c2ccc(cc2)C(F)(F)F)ccc1OCC(O)=O
Show InChI InChI=1S/C30H22F6O4/c1-18-12-26(10-11-27(18)40-17-28(37)38)39-16-19-13-22(20-2-6-24(7-3-20)29(31,32)33)15-23(14-19)21-4-8-25(9-5-21)30(34,35)36/h2-15H,16-17H2,1H3,(H,37,38)
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n/an/an/an/a>1.00E+4n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50184652
PNG
(CHEMBL210469 | [4-(4,4''-Bis-trifluoromethyl-[1,1'...)
Show SMILES Cc1cc(OCc2cc(cc(c2)-c2ccc(cc2)C(F)(F)F)-c2ccc(cc2)C(F)(F)F)ccc1OCC(O)=O
Show InChI InChI=1S/C30H22F6O4/c1-18-12-26(10-11-27(18)40-17-28(37)38)39-16-19-13-22(20-2-6-24(7-3-20)29(31,32)33)15-23(14-19)21-4-8-25(9-5-21)30(34,35)36/h2-15H,16-17H2,1H3,(H,37,38)
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n/an/an/an/a 10n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARdelta ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50312465
PNG
(2-(3-(4-(2-(3,5-dichlorophenoxy)ethylcarbamoyl)-5-...)
Show SMILES OC(=O)Cc1cccc(c1)-c1noc(c1C(=O)NCCOc1cc(Cl)cc(Cl)c1)-c1ccccc1
Show InChI InChI=1S/C26H20Cl2N2O5/c27-19-13-20(28)15-21(14-19)34-10-9-29-26(33)23-24(18-8-4-5-16(11-18)12-22(31)32)30-35-25(23)17-6-2-1-3-7-17/h1-8,11,13-15H,9-10,12H2,(H,29,33)(H,31,32)
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n/an/an/an/a>1.00E+4n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50312465
PNG
(2-(3-(4-(2-(3,5-dichlorophenoxy)ethylcarbamoyl)-5-...)
Show SMILES OC(=O)Cc1cccc(c1)-c1noc(c1C(=O)NCCOc1cc(Cl)cc(Cl)c1)-c1ccccc1
Show InChI InChI=1S/C26H20Cl2N2O5/c27-19-13-20(28)15-21(14-19)34-10-9-29-26(33)23-24(18-8-4-5-16(11-18)12-22(31)32)30-35-25(23)17-6-2-1-3-7-17/h1-8,11,13-15H,9-10,12H2,(H,29,33)(H,31,32)
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n/an/an/an/a>1.00E+4n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50312465
PNG
(2-(3-(4-(2-(3,5-dichlorophenoxy)ethylcarbamoyl)-5-...)
Show SMILES OC(=O)Cc1cccc(c1)-c1noc(c1C(=O)NCCOc1cc(Cl)cc(Cl)c1)-c1ccccc1
Show InChI InChI=1S/C26H20Cl2N2O5/c27-19-13-20(28)15-21(14-19)34-10-9-29-26(33)23-24(18-8-4-5-16(11-18)12-22(31)32)30-35-25(23)17-6-2-1-3-7-17/h1-8,11,13-15H,9-10,12H2,(H,29,33)(H,31,32)
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n/an/an/an/a 70n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARdelta ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50312466
PNG
(2-(3-(4,5-bis(4-methoxyphenyl)thiazol-2-ylthio)phe...)
Show SMILES COc1ccc(cc1)-c1nc(Sc2cccc(c2)C(C)C(O)=O)sc1-c1ccc(OC)cc1
Show InChI InChI=1S/C26H23NO4S2/c1-16(25(28)29)19-5-4-6-22(15-19)32-26-27-23(17-7-11-20(30-2)12-8-17)24(33-26)18-9-13-21(31-3)14-10-18/h4-16H,1-3H3,(H,28,29)
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n/an/an/an/a 300n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
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