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Compile Data Set for Download or QSAR

Found 118 hits with Last Name = 'ayscue' and Initial = 'ah'   
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


(Homo sapiens (Human))
BDBM50085044
PNG
((S)-2-(2-Benzoyl-phenylamino)-3-{4-[2-(5-methyl-2-...)
Show SMILES Cc1oc(nc1CCOc1ccc(C[C@H](Nc2ccccc2C(=O)c2ccccc2)C(O)=O)cc1)-c1ccccc1
Show InChI InChI=1S/C34H30N2O5/c1-23-29(36-33(41-23)26-12-6-3-7-13-26)20-21-40-27-18-16-24(17-19-27)22-31(34(38)39)35-30-15-9-8-14-28(30)32(37)25-10-4-2-5-11-25/h2-19,31,35H,20-22H2,1H3,(H,38,39)/t31-/m0/s1
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1.10n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Binding affinity to human Peroxisome proliferator activated receptor gamma using scintillation proximity assay


Bioorg Med Chem Lett 11: 3111-3 (2001)


BindingDB Entry DOI: 10.7270/Q2B27TKM
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50085046
PNG
(2-((S)-1-carboxy-2-{4-[2-(5-methyl-2-phenyl-oxazol...)
Show SMILES COC(=O)c1ccccc1N[C@@H](Cc1ccc(OCCc2nc(oc2C)-c2ccccc2)cc1)C(O)=O
Show InChI InChI=1S/C29H28N2O6/c1-19-24(31-27(37-19)21-8-4-3-5-9-21)16-17-36-22-14-12-20(13-15-22)18-26(28(32)33)30-25-11-7-6-10-23(25)29(34)35-2/h3-15,26,30H,16-18H2,1-2H3,(H,32,33)/t26-/m0/s1
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3.70n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Binding affinity to human Peroxisome proliferator activated receptor gamma using scintillation proximity assay


Bioorg Med Chem Lett 11: 3111-3 (2001)


BindingDB Entry DOI: 10.7270/Q2B27TKM
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM34017
PNG
(CHEMBL104850 | phenylpropanoic acid derivative, 7)
Show SMILES Cc1oc(nc1CCOc1ccc(C[C@@H](C(O)=O)n2cccc2)cc1)-c1ccccc1 |r|
Show InChI InChI=1S/C25H24N2O4/c1-18-22(26-24(31-18)20-7-3-2-4-8-20)13-16-30-21-11-9-19(10-12-21)17-23(25(28)29)27-14-5-6-15-27/h2-12,14-15,23H,13,16-17H2,1H3,(H,28,29)/t23-/m0/s1
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6.90n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Maximal reporter activity against human Peroxisome proliferator activated receptor gamma Gal4 chimeric in transiently transfected CV-1 cells by funct...


Bioorg Med Chem Lett 11: 3111-3 (2001)


BindingDB Entry DOI: 10.7270/Q2B27TKM
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM34017
PNG
(CHEMBL104850 | phenylpropanoic acid derivative, 7)
Show SMILES Cc1oc(nc1CCOc1ccc(C[C@@H](C(O)=O)n2cccc2)cc1)-c1ccccc1 |r|
Show InChI InChI=1S/C25H24N2O4/c1-18-22(26-24(31-18)20-7-3-2-4-8-20)13-16-30-21-11-9-19(10-12-21)17-23(25(28)29)27-14-5-6-15-27/h2-12,14-15,23H,13,16-17H2,1H3,(H,28,29)/t23-/m0/s1
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51n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Binding affinity to human Peroxisome proliferator activated receptor gamma using scintillation proximity assay


Bioorg Med Chem Lett 11: 3111-3 (2001)


BindingDB Entry DOI: 10.7270/Q2B27TKM
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50106960
PNG
((S)-3-{4-[2-(5-Methyl-2-phenyl-oxazol-4-yl)-ethoxy...)
Show SMILES CCCN[C@@H](Cc1ccc(OCCc2nc(oc2C)-c2ccccc2)cc1)C(O)=O
Show InChI InChI=1S/C24H28N2O4/c1-3-14-25-22(24(27)28)16-18-9-11-20(12-10-18)29-15-13-21-17(2)30-23(26-21)19-7-5-4-6-8-19/h4-12,22,25H,3,13-16H2,1-2H3,(H,27,28)/t22-/m0/s1
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52n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL




Bioorg Med Chem Lett 11: 3111-3 (2001)


BindingDB Entry DOI: 10.7270/Q2B27TKM
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50106960
PNG
((S)-3-{4-[2-(5-Methyl-2-phenyl-oxazol-4-yl)-ethoxy...)
Show SMILES CCCN[C@@H](Cc1ccc(OCCc2nc(oc2C)-c2ccccc2)cc1)C(O)=O
Show InChI InChI=1S/C24H28N2O4/c1-3-14-25-22(24(27)28)16-18-9-11-20(12-10-18)29-15-13-21-17(2)30-23(26-21)19-7-5-4-6-8-19/h4-12,22,25H,3,13-16H2,1-2H3,(H,27,28)/t22-/m0/s1
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72n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Binding affinity to human Peroxisome proliferator activated receptor gamma using scintillation proximity assay


Bioorg Med Chem Lett 11: 3111-3 (2001)


BindingDB Entry DOI: 10.7270/Q2B27TKM
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM28681
PNG
(5-[(4-{2-[methyl(pyridin-2-yl)amino]ethoxy}phenyl)...)
Show SMILES CN(CCOc1ccc(Cc2sc(=O)[nH]c2O)cc1)c1ccccn1
Show InChI InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,22H,10-12H2,1H3,(H,20,23)
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120n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Binding affinity to human Peroxisome proliferator activated receptor gamma using scintillation proximity assay


Bioorg Med Chem Lett 11: 3111-3 (2001)


BindingDB Entry DOI: 10.7270/Q2B27TKM
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50106967
PNG
((S)-3-{4-[2-(5-Methyl-2-phenyl-oxazol-4-yl)-ethoxy...)
Show SMILES Cc1oc(nc1CCOc1ccc(C[C@H](N2CCOCC2)C(O)=O)cc1)-c1ccccc1
Show InChI InChI=1S/C25H28N2O5/c1-18-22(26-24(32-18)20-5-3-2-4-6-20)11-14-31-21-9-7-19(8-10-21)17-23(25(28)29)27-12-15-30-16-13-27/h2-10,23H,11-17H2,1H3,(H,28,29)/t23-/m0/s1
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158n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Binding affinity to human Peroxisome proliferator activated receptor gamma using scintillation proximity assay


Bioorg Med Chem Lett 11: 3111-3 (2001)


BindingDB Entry DOI: 10.7270/Q2B27TKM
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50106965
PNG
((S)-3-{4-[2-(5-Methyl-2-phenyl-oxazol-4-yl)-ethoxy...)
Show SMILES Cc1oc(nc1CCOc1ccc(C[C@H](Nc2ncccn2)C(O)=O)cc1)-c1ccccc1
Show InChI InChI=1S/C25H24N4O4/c1-17-21(28-23(33-17)19-6-3-2-4-7-19)12-15-32-20-10-8-18(9-11-20)16-22(24(30)31)29-25-26-13-5-14-27-25/h2-11,13-14,22H,12,15-16H2,1H3,(H,30,31)(H,26,27,29)/t22-/m0/s1
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280n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Binding affinity to human Peroxisome proliferator activated receptor gamma using scintillation proximity assay


Bioorg Med Chem Lett 11: 3111-3 (2001)


BindingDB Entry DOI: 10.7270/Q2B27TKM
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50106964
PNG
((S)-3-{4-[2-(5-Methyl-2-phenyl-oxazol-4-yl)-ethoxy...)
Show SMILES Cc1oc(nc1CCOc1ccc(C[C@H](N2CCCC2)C(O)=O)cc1)-c1ccccc1
Show InChI InChI=1S/C25H28N2O4/c1-18-22(26-24(31-18)20-7-3-2-4-8-20)13-16-30-21-11-9-19(10-12-21)17-23(25(28)29)27-14-5-6-15-27/h2-4,7-12,23H,5-6,13-17H2,1H3,(H,28,29)/t23-/m0/s1
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360n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Binding affinity to human Peroxisome proliferator activated receptor gamma using scintillation proximity assay


Bioorg Med Chem Lett 11: 3111-3 (2001)


BindingDB Entry DOI: 10.7270/Q2B27TKM
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50106966
PNG
((S)-3-{4-[2-(5-Methyl-2-phenyl-oxazol-4-yl)-ethoxy...)
Show SMILES Cc1oc(nc1CCOc1ccc(C[C@H](N2CCCCC2)C(O)=O)cc1)-c1ccccc1
Show InChI InChI=1S/C26H30N2O4/c1-19-23(27-25(32-19)21-8-4-2-5-9-21)14-17-31-22-12-10-20(11-13-22)18-24(26(29)30)28-15-6-3-7-16-28/h2,4-5,8-13,24H,3,6-7,14-18H2,1H3,(H,29,30)/t24-/m0/s1
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480n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Binding affinity to human Peroxisome proliferator activated receptor gamma using scintillation proximity assay


Bioorg Med Chem Lett 11: 3111-3 (2001)


BindingDB Entry DOI: 10.7270/Q2B27TKM
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50085044
PNG
((S)-2-(2-Benzoyl-phenylamino)-3-{4-[2-(5-methyl-2-...)
Show SMILES Cc1oc(nc1CCOc1ccc(C[C@H](Nc2ccccc2C(=O)c2ccccc2)C(O)=O)cc1)-c1ccccc1
Show InChI InChI=1S/C34H30N2O5/c1-23-29(36-33(41-23)26-12-6-3-7-13-26)20-21-40-27-18-16-24(17-19-27)22-31(34(38)39)35-30-15-9-8-14-28(30)32(37)25-10-4-2-5-11-25/h2-19,31,35H,20-22H2,1H3,(H,38,39)/t31-/m0/s1
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490n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Maximal reporter activity against human Peroxisome proliferator activated receptor alpha Gal4 chimeric in transiently transfected CV-1 cells by funct...


Bioorg Med Chem Lett 11: 3111-3 (2001)


BindingDB Entry DOI: 10.7270/Q2B27TKM
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM34017
PNG
(CHEMBL104850 | phenylpropanoic acid derivative, 7)
Show SMILES Cc1oc(nc1CCOc1ccc(C[C@@H](C(O)=O)n2cccc2)cc1)-c1ccccc1 |r|
Show InChI InChI=1S/C25H24N2O4/c1-18-22(26-24(31-18)20-7-3-2-4-8-20)13-16-30-21-11-9-19(10-12-21)17-23(25(28)29)27-14-5-6-15-27/h2-12,14-15,23H,13,16-17H2,1H3,(H,28,29)/t23-/m0/s1
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560n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Binding affinity to human Peroxisome proliferator activated receptor alpha using scintillation proximity assay


Bioorg Med Chem Lett 11: 3111-3 (2001)


BindingDB Entry DOI: 10.7270/Q2B27TKM
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50106963
PNG
((S)-2-Methanesulfonylamino-3-{4-[2-(5-methyl-2-phe...)
Show SMILES Cc1oc(nc1CCOc1ccc(C[C@H](NS(C)(=O)=O)C(O)=O)cc1)-c1ccccc1
Show InChI InChI=1S/C22H24N2O6S/c1-15-19(23-21(30-15)17-6-4-3-5-7-17)12-13-29-18-10-8-16(9-11-18)14-20(22(25)26)24-31(2,27)28/h3-11,20,24H,12-14H2,1-2H3,(H,25,26)/t20-/m0/s1
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620n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Maximal reporter activity against human Peroxisome proliferator activated receptor gamma Gal4 chimeric in transiently transfected CV-1 cells by funct...


Bioorg Med Chem Lett 11: 3111-3 (2001)


BindingDB Entry DOI: 10.7270/Q2B27TKM
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50049240
PNG
((+-)-5-((4-(2-(5-ethyl-2-pyridinyl)ethoxy)phenyl)m...)
Show SMILES CCc1ccc(CCOc2ccc(Cc3sc(=O)[nH]c3O)cc2)nc1
Show InChI InChI=1S/C19H20N2O3S/c1-2-13-3-6-15(20-12-13)9-10-24-16-7-4-14(5-8-16)11-17-18(22)21-19(23)25-17/h3-8,12,22H,2,9-11H2,1H3,(H,21,23)
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630n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Maximal reporter activity against human Peroxisome proliferator activated receptor alpha Gal4 chimeric in transiently transfected CV-1 cells by funct...


Bioorg Med Chem Lett 11: 3111-3 (2001)


BindingDB Entry DOI: 10.7270/Q2B27TKM
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50106959
PNG
((S)-2-Dimethylamino-3-{4-[2-(5-methyl-2-phenyl-oxa...)
Show SMILES CN(C)[C@@H](Cc1ccc(OCCc2nc(oc2C)-c2ccccc2)cc1)C(O)=O
Show InChI InChI=1S/C23H26N2O4/c1-16-20(24-22(29-16)18-7-5-4-6-8-18)13-14-28-19-11-9-17(10-12-19)15-21(23(26)27)25(2)3/h4-12,21H,13-15H2,1-3H3,(H,26,27)/t21-/m0/s1
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850n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Binding affinity to human Peroxisome proliferator activated receptor gamma using scintillation proximity assay


Bioorg Med Chem Lett 11: 3111-3 (2001)


BindingDB Entry DOI: 10.7270/Q2B27TKM
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50106968
PNG
((S)-2-(2,5-Dimethyl-pyrrol-1-yl)-3-{4-[2-(5-methyl...)
Show SMILES Cc1ccc(C)n1[C@@H](Cc1ccc(OCCc2nc(oc2C)-c2ccccc2)cc1)C(O)=O
Show InChI InChI=1S/C27H28N2O4/c1-18-9-10-19(2)29(18)25(27(30)31)17-21-11-13-23(14-12-21)32-16-15-24-20(3)33-26(28-24)22-7-5-4-6-8-22/h4-14,25H,15-17H2,1-3H3,(H,30,31)/t25-/m0/s1
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980n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Binding affinity to human Peroxisome proliferator activated receptor gamma using scintillation proximity assay


Bioorg Med Chem Lett 11: 3111-3 (2001)


BindingDB Entry DOI: 10.7270/Q2B27TKM
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50085046
PNG
(2-((S)-1-carboxy-2-{4-[2-(5-methyl-2-phenyl-oxazol...)
Show SMILES COC(=O)c1ccccc1N[C@@H](Cc1ccc(OCCc2nc(oc2C)-c2ccccc2)cc1)C(O)=O
Show InChI InChI=1S/C29H28N2O6/c1-19-24(31-27(37-19)21-8-4-3-5-9-21)16-17-36-22-14-12-20(13-15-22)18-26(28(32)33)30-25-11-7-6-10-23(25)29(34)35-2/h3-15,26,30H,16-18H2,1-2H3,(H,32,33)/t26-/m0/s1
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1.10E+3n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Binding affinity to human Peroxisome proliferator activated receptor alpha using scintillation proximity assay


Bioorg Med Chem Lett 11: 3111-3 (2001)


BindingDB Entry DOI: 10.7270/Q2B27TKM
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50085044
PNG
((S)-2-(2-Benzoyl-phenylamino)-3-{4-[2-(5-methyl-2-...)
Show SMILES Cc1oc(nc1CCOc1ccc(C[C@H](Nc2ccccc2C(=O)c2ccccc2)C(O)=O)cc1)-c1ccccc1
Show InChI InChI=1S/C34H30N2O5/c1-23-29(36-33(41-23)26-12-6-3-7-13-26)20-21-40-27-18-16-24(17-19-27)22-31(34(38)39)35-30-15-9-8-14-28(30)32(37)25-10-4-2-5-11-25/h2-19,31,35H,20-22H2,1H3,(H,38,39)/t31-/m0/s1
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1.20E+3n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Binding affinityto bind to human Peroxisome proliferator activated receptor delta using scintillation proximity assay


Bioorg Med Chem Lett 11: 3111-3 (2001)


BindingDB Entry DOI: 10.7270/Q2B27TKM
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50106965
PNG
((S)-3-{4-[2-(5-Methyl-2-phenyl-oxazol-4-yl)-ethoxy...)
Show SMILES Cc1oc(nc1CCOc1ccc(C[C@H](Nc2ncccn2)C(O)=O)cc1)-c1ccccc1
Show InChI InChI=1S/C25H24N4O4/c1-17-21(28-23(33-17)19-6-3-2-4-7-19)12-15-32-20-10-8-18(9-11-20)16-22(24(30)31)29-25-26-13-5-14-27-25/h2-11,13-14,22H,12,15-16H2,1H3,(H,30,31)(H,26,27,29)/t22-/m0/s1
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1.20E+3n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Binding affinity to human Peroxisome proliferator activated receptor alpha using scintillation proximity assay


Bioorg Med Chem Lett 11: 3111-3 (2001)


BindingDB Entry DOI: 10.7270/Q2B27TKM
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50085046
PNG
(2-((S)-1-carboxy-2-{4-[2-(5-methyl-2-phenyl-oxazol...)
Show SMILES COC(=O)c1ccccc1N[C@@H](Cc1ccc(OCCc2nc(oc2C)-c2ccccc2)cc1)C(O)=O
Show InChI InChI=1S/C29H28N2O6/c1-19-24(31-27(37-19)21-8-4-3-5-9-21)16-17-36-22-14-12-20(13-15-22)18-26(28(32)33)30-25-11-7-6-10-23(25)29(34)35-2/h3-15,26,30H,16-18H2,1-2H3,(H,32,33)/t26-/m0/s1
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1.20E+3n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Binding affinityto bind to human Peroxisome proliferator activated receptor delta using scintillation proximity assay


Bioorg Med Chem Lett 11: 3111-3 (2001)


BindingDB Entry DOI: 10.7270/Q2B27TKM
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50106962
PNG
((S)-2-Methylamino-3-{4-[2-(5-methyl-2-phenyl-oxazo...)
Show SMILES CN[C@@H](Cc1ccc(OCCc2nc(oc2C)-c2ccccc2)cc1)C(O)=O
Show InChI InChI=1S/C22H24N2O4/c1-15-19(24-21(28-15)17-6-4-3-5-7-17)12-13-27-18-10-8-16(9-11-18)14-20(23-2)22(25)26/h3-11,20,23H,12-14H2,1-2H3,(H,25,26)/t20-/m0/s1
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2.10E+3n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL




Bioorg Med Chem Lett 11: 3111-3 (2001)


BindingDB Entry DOI: 10.7270/Q2B27TKM
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM34017
PNG
(CHEMBL104850 | phenylpropanoic acid derivative, 7)
Show SMILES Cc1oc(nc1CCOc1ccc(C[C@@H](C(O)=O)n2cccc2)cc1)-c1ccccc1 |r|
Show InChI InChI=1S/C25H24N2O4/c1-18-22(26-24(31-18)20-7-3-2-4-8-20)13-16-30-21-11-9-19(10-12-21)17-23(25(28)29)27-14-5-6-15-27/h2-12,14-15,23H,13,16-17H2,1H3,(H,28,29)/t23-/m0/s1
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2.50E+3n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Binding affinityto bind to human Peroxisome proliferator activated receptor delta using scintillation proximity assay


Bioorg Med Chem Lett 11: 3111-3 (2001)


BindingDB Entry DOI: 10.7270/Q2B27TKM
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM34017
PNG
(CHEMBL104850 | phenylpropanoic acid derivative, 7)
Show SMILES Cc1oc(nc1CCOc1ccc(C[C@@H](C(O)=O)n2cccc2)cc1)-c1ccccc1 |r|
Show InChI InChI=1S/C25H24N2O4/c1-18-22(26-24(31-18)20-7-3-2-4-8-20)13-16-30-21-11-9-19(10-12-21)17-23(25(28)29)27-14-5-6-15-27/h2-12,14-15,23H,13,16-17H2,1H3,(H,28,29)/t23-/m0/s1
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2.60E+3n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Binding affinity to human Peroxisome proliferator activated receptor gamma using scintillation proximity assay


Bioorg Med Chem Lett 11: 3111-3 (2001)


BindingDB Entry DOI: 10.7270/Q2B27TKM
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50106961
PNG
((S)-2-Acetylamino-3-{4-[2-(5-methyl-2-phenyl-oxazo...)
Show SMILES CC(=O)N[C@@H](Cc1ccc(OCCc2nc(oc2C)-c2ccccc2)cc1)C(O)=O
Show InChI InChI=1S/C23H24N2O5/c1-15-20(25-22(30-15)18-6-4-3-5-7-18)12-13-29-19-10-8-17(9-11-19)14-21(23(27)28)24-16(2)26/h3-11,21H,12-14H2,1-2H3,(H,24,26)(H,27,28)/t21-/m0/s1
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2.60E+3n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Maximal reporter activity against human Peroxisome proliferator activated receptor gamma Gal4 chimeric in transiently transfected CV-1 cells by funct...


Bioorg Med Chem Lett 11: 3111-3 (2001)


BindingDB Entry DOI: 10.7270/Q2B27TKM
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50085044
PNG
((S)-2-(2-Benzoyl-phenylamino)-3-{4-[2-(5-methyl-2-...)
Show SMILES Cc1oc(nc1CCOc1ccc(C[C@H](Nc2ccccc2C(=O)c2ccccc2)C(O)=O)cc1)-c1ccccc1
Show InChI InChI=1S/C34H30N2O5/c1-23-29(36-33(41-23)26-12-6-3-7-13-26)20-21-40-27-18-16-24(17-19-27)22-31(34(38)39)35-30-15-9-8-14-28(30)32(37)25-10-4-2-5-11-25/h2-19,31,35H,20-22H2,1H3,(H,38,39)/t31-/m0/s1
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n/an/an/an/a 450n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Maximal reporter activity against human Peroxisome proliferator activated receptor alpha Gal4 chimeric in transiently transfected CV-1 cells by funct...


Bioorg Med Chem Lett 11: 3111-3 (2001)


BindingDB Entry DOI: 10.7270/Q2B27TKM
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50106960
PNG
((S)-3-{4-[2-(5-Methyl-2-phenyl-oxazol-4-yl)-ethoxy...)
Show SMILES CCCN[C@@H](Cc1ccc(OCCc2nc(oc2C)-c2ccccc2)cc1)C(O)=O
Show InChI InChI=1S/C24H28N2O4/c1-3-14-25-22(24(27)28)16-18-9-11-20(12-10-18)29-15-13-21-17(2)30-23(26-21)19-7-5-4-6-8-19/h4-12,22,25H,3,13-16H2,1-2H3,(H,27,28)/t22-/m0/s1
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n/an/an/an/a 830n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Maximal reporter activity against human Peroxisome proliferator activated receptor alpha Gal4 chimeric in transiently transfected CV-1 cells by funct...


Bioorg Med Chem Lett 11: 3111-3 (2001)


BindingDB Entry DOI: 10.7270/Q2B27TKM
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50049240
PNG
((+-)-5-((4-(2-(5-ethyl-2-pyridinyl)ethoxy)phenyl)m...)
Show SMILES CCc1ccc(CCOc2ccc(Cc3sc(=O)[nH]c3O)cc2)nc1
Show InChI InChI=1S/C19H20N2O3S/c1-2-13-3-6-15(20-12-13)9-10-24-16-7-4-14(5-8-16)11-17-18(22)21-19(23)25-17/h3-8,12,22H,2,9-11H2,1H3,(H,21,23)
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n/an/an/an/a 580n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Maximal reporter activity against human Peroxisome proliferator activated receptor gamma Gal4 chimeric in transiently transfected CV-1 cells by funct...


Bioorg Med Chem Lett 11: 3111-3 (2001)


BindingDB Entry DOI: 10.7270/Q2B27TKM
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50106960
PNG
((S)-3-{4-[2-(5-Methyl-2-phenyl-oxazol-4-yl)-ethoxy...)
Show SMILES CCCN[C@@H](Cc1ccc(OCCc2nc(oc2C)-c2ccccc2)cc1)C(O)=O
Show InChI InChI=1S/C24H28N2O4/c1-3-14-25-22(24(27)28)16-18-9-11-20(12-10-18)29-15-13-21-17(2)30-23(26-21)19-7-5-4-6-8-19/h4-12,22,25H,3,13-16H2,1-2H3,(H,27,28)/t22-/m0/s1
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n/an/an/an/a 240n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Maximal reporter activity against human Peroxisome proliferator activated receptor gamma Gal4 chimeric in transiently transfected CV-1 cells by funct...


Bioorg Med Chem Lett 11: 3111-3 (2001)


BindingDB Entry DOI: 10.7270/Q2B27TKM
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50106962
PNG
((S)-2-Methylamino-3-{4-[2-(5-methyl-2-phenyl-oxazo...)
Show SMILES CN[C@@H](Cc1ccc(OCCc2nc(oc2C)-c2ccccc2)cc1)C(O)=O
Show InChI InChI=1S/C22H24N2O4/c1-15-19(24-21(28-15)17-6-4-3-5-7-17)12-13-27-18-10-8-16(9-11-18)14-20(23-2)22(25)26/h3-11,20,23H,12-14H2,1-2H3,(H,25,26)/t20-/m0/s1
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n/an/an/an/a 5.00E+3n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Maximal reporter activity against human Peroxisome proliferator activated receptor gamma Gal4 chimeric in transiently transfected CV-1 cells by funct...


Bioorg Med Chem Lett 11: 3111-3 (2001)


BindingDB Entry DOI: 10.7270/Q2B27TKM
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50085044
PNG
((S)-2-(2-Benzoyl-phenylamino)-3-{4-[2-(5-methyl-2-...)
Show SMILES Cc1oc(nc1CCOc1ccc(C[C@H](Nc2ccccc2C(=O)c2ccccc2)C(O)=O)cc1)-c1ccccc1
Show InChI InChI=1S/C34H30N2O5/c1-23-29(36-33(41-23)26-12-6-3-7-13-26)20-21-40-27-18-16-24(17-19-27)22-31(34(38)39)35-30-15-9-8-14-28(30)32(37)25-10-4-2-5-11-25/h2-19,31,35H,20-22H2,1H3,(H,38,39)/t31-/m0/s1
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n/an/an/an/a 0.340n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Maximal reporter activity against human Peroxisome proliferator activated receptor gamma Gal4 chimeric in transiently transfected CV-1 cells by funct...


Bioorg Med Chem Lett 11: 3111-3 (2001)


BindingDB Entry DOI: 10.7270/Q2B27TKM
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM28681
PNG
(5-[(4-{2-[methyl(pyridin-2-yl)amino]ethoxy}phenyl)...)
Show SMILES CN(CCOc1ccc(Cc2sc(=O)[nH]c2O)cc1)c1ccccn1
Show InChI InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,22H,10-12H2,1H3,(H,20,23)
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n/an/an/an/a 43n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Maximal reporter activity against human Peroxisome proliferator activated receptor gamma Gal4 chimeric in transiently transfected CV-1 cells by funct...


Bioorg Med Chem Lett 11: 3111-3 (2001)


BindingDB Entry DOI: 10.7270/Q2B27TKM
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50103940
PNG
(3-(4-((5-(3,5-bis(trifluoromethyl)phenyl)-1,2,4-ox...)
Show SMILES CC(C)OC(Cc1ccc(OCc2noc(n2)-c2cc(cc(c2)C(F)(F)F)C(F)(F)F)cc1)C(O)=O
Show InChI InChI=1S/C23H20F6N2O5/c1-12(2)35-18(21(32)33)7-13-3-5-17(6-4-13)34-11-19-30-20(36-31-19)14-8-15(22(24,25)26)10-16(9-14)23(27,28)29/h3-6,8-10,12,18H,7,11H2,1-2H3,(H,32,33)
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n/an/an/an/a 630n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity of the compound against human Peroxisome proliferator activated receptor delta in CV-1 cell was determined


Bioorg Med Chem Lett 11: 2385-8 (2001)


BindingDB Entry DOI: 10.7270/Q2CJ8CSF
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50103939
PNG
(2-Isopropoxy-3-[4-(5-o-tolyl-[1,2,4]oxadiazol-3-yl...)
Show SMILES CC(C)OC(Cc1ccc(OCc2noc(n2)-c2ccccc2C)cc1)C(O)=O
Show InChI InChI=1S/C22H24N2O5/c1-14(2)28-19(22(25)26)12-16-8-10-17(11-9-16)27-13-20-23-21(29-24-20)18-7-5-4-6-15(18)3/h4-11,14,19H,12-13H2,1-3H3,(H,25,26)
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n/an/an/an/a 40n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity against human Peroxisome proliferator activated receptor alpha receptor in CV-1 cell was determined


Bioorg Med Chem Lett 11: 2385-8 (2001)


BindingDB Entry DOI: 10.7270/Q2CJ8CSF
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50103938
PNG
(2-Isopropoxy-3-[4-(5-phenyl-[1,2,4]oxadiazol-3-ylm...)
Show SMILES CC(C)OC(Cc1ccc(OCc2noc(n2)-c2ccccc2)cc1)C(O)=O
Show InChI InChI=1S/C21H22N2O5/c1-14(2)27-18(21(24)25)12-15-8-10-17(11-9-15)26-13-19-22-20(28-23-19)16-6-4-3-5-7-16/h3-11,14,18H,12-13H2,1-2H3,(H,24,25)
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n/an/an/an/a 160n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity against human Peroxisome proliferator activated receptor alpha receptor in CV-1 cell was determined


Bioorg Med Chem Lett 11: 2385-8 (2001)


BindingDB Entry DOI: 10.7270/Q2CJ8CSF
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50103941
PNG
(2-Isopropoxy-3-(4-{2-[5-(3-trifluoromethyl-phenyl)...)
Show SMILES CC(C)OC(Cc1ccc(OCCc2noc(n2)-c2cccc(c2)C(F)(F)F)cc1)C(O)=O
Show InChI InChI=1S/C23H23F3N2O5/c1-14(2)32-19(22(29)30)12-15-6-8-18(9-7-15)31-11-10-20-27-21(33-28-20)16-4-3-5-17(13-16)23(24,25)26/h3-9,13-14,19H,10-12H2,1-2H3,(H,29,30)
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n/an/an/an/a 200n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity against human Peroxisome proliferator activated receptor alpha receptor in CV-1 cell was determined


Bioorg Med Chem Lett 11: 2385-8 (2001)


BindingDB Entry DOI: 10.7270/Q2CJ8CSF
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50103939
PNG
(2-Isopropoxy-3-[4-(5-o-tolyl-[1,2,4]oxadiazol-3-yl...)
Show SMILES CC(C)OC(Cc1ccc(OCc2noc(n2)-c2ccccc2C)cc1)C(O)=O
Show InChI InChI=1S/C22H24N2O5/c1-14(2)28-19(22(25)26)12-16-8-10-17(11-9-16)27-13-20-23-21(29-24-20)18-7-5-4-6-15(18)3/h4-11,14,19H,12-13H2,1-3H3,(H,25,26)
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n/an/an/an/a 1.60E+3n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity against human PPAR delta receptor in CV-1 cell was determined


Bioorg Med Chem Lett 11: 2385-8 (2001)


BindingDB Entry DOI: 10.7270/Q2CJ8CSF
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50103942
PNG
(3-(4-((5-cyclohexyl-1,2,4-oxadiazol-3-yl)methoxy)p...)
Show SMILES CC(C)OC(Cc1ccc(OCc2noc(n2)C2CCCCC2)cc1)C(O)=O
Show InChI InChI=1S/C21H28N2O5/c1-14(2)27-18(21(24)25)12-15-8-10-17(11-9-15)26-13-19-22-20(28-23-19)16-6-4-3-5-7-16/h8-11,14,16,18H,3-7,12-13H2,1-2H3,(H,24,25)
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n/an/an/an/a 240n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity against human Peroxisome proliferator activated receptor alpha receptor in CV-1 cell was determined


Bioorg Med Chem Lett 11: 2385-8 (2001)


BindingDB Entry DOI: 10.7270/Q2CJ8CSF
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50103943
PNG
(3-(4-((5-(4-chlorophenyl)-1,2,4-oxadiazol-3-yl)met...)
Show SMILES CC(C)OC(Cc1ccc(OCc2noc(n2)-c2ccc(Cl)cc2)cc1)C(O)=O
Show InChI InChI=1S/C21H21ClN2O5/c1-13(2)28-18(21(25)26)11-14-3-9-17(10-4-14)27-12-19-23-20(29-24-19)15-5-7-16(22)8-6-15/h3-10,13,18H,11-12H2,1-2H3,(H,25,26)
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n/an/an/an/a 13n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity against human Peroxisome proliferator activated receptor alpha receptor in CV-1 cell was determined


Bioorg Med Chem Lett 11: 2385-8 (2001)


BindingDB Entry DOI: 10.7270/Q2CJ8CSF
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50103945
PNG
(2-Isopropoxy-3-(4-{2-[5-(2-trifluoromethyl-phenyl)...)
Show SMILES CC(C)OC(Cc1ccc(OCCc2noc(n2)-c2ccccc2C(F)(F)F)cc1)C(O)=O
Show InChI InChI=1S/C23H23F3N2O5/c1-14(2)32-19(22(29)30)13-15-7-9-16(10-8-15)31-12-11-20-27-21(33-28-20)17-5-3-4-6-18(17)23(24,25)26/h3-10,14,19H,11-13H2,1-2H3,(H,29,30)
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n/an/an/an/a 400n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity of the compound against human Peroxisome proliferator activated receptor alpha in CV-1 cell was determined


Bioorg Med Chem Lett 11: 2385-8 (2001)


BindingDB Entry DOI: 10.7270/Q2CJ8CSF
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50103946
PNG
(3-(4-((5-(3,5-difluorophenyl)-1,2,4-oxadiazol-3-yl...)
Show SMILES CC(C)OC(Cc1ccc(OCc2noc(n2)-c2cc(F)cc(F)c2)cc1)C(O)=O
Show InChI InChI=1S/C21H20F2N2O5/c1-12(2)29-18(21(26)27)7-13-3-5-17(6-4-13)28-11-19-24-20(30-25-19)14-8-15(22)10-16(23)9-14/h3-6,8-10,12,18H,7,11H2,1-2H3,(H,26,27)
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n/an/an/an/a 100n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity against human Peroxisome proliferator activated receptor gamma receptor in CV-1 cell was determined


Bioorg Med Chem Lett 11: 2385-8 (2001)


BindingDB Entry DOI: 10.7270/Q2CJ8CSF
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50103947
PNG
(3-(4-((5-(4-bromophenyl)-1,2,4-oxadiazol-3-yl)meth...)
Show SMILES CC(C)OC(Cc1ccc(OCc2noc(n2)-c2ccc(Br)cc2)cc1)C(O)=O
Show InChI InChI=1S/C21H21BrN2O5/c1-13(2)28-18(21(25)26)11-14-3-9-17(10-4-14)27-12-19-23-20(29-24-19)15-5-7-16(22)8-6-15/h3-10,13,18H,11-12H2,1-2H3,(H,25,26)
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n/an/an/an/a 40n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity against human Peroxisome proliferator activated receptor alpha receptor in CV-1 cell was determined


Bioorg Med Chem Lett 11: 2385-8 (2001)


BindingDB Entry DOI: 10.7270/Q2CJ8CSF
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50103947
PNG
(3-(4-((5-(4-bromophenyl)-1,2,4-oxadiazol-3-yl)meth...)
Show SMILES CC(C)OC(Cc1ccc(OCc2noc(n2)-c2ccc(Br)cc2)cc1)C(O)=O
Show InChI InChI=1S/C21H21BrN2O5/c1-13(2)28-18(21(25)26)11-14-3-9-17(10-4-14)27-12-19-23-20(29-24-19)15-5-7-16(22)8-6-15/h3-10,13,18H,11-12H2,1-2H3,(H,25,26)
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n/an/an/an/a 790n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity against human PPAR delta receptor in CV-1 cell was determined


Bioorg Med Chem Lett 11: 2385-8 (2001)


BindingDB Entry DOI: 10.7270/Q2CJ8CSF
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50103950
PNG
(2-Isopropoxy-3-{4-[5-(4-isopropyl-phenyl)-[1,2,4]o...)
Show SMILES CC(C)OC(Cc1ccc(OCc2noc(n2)-c2ccc(cc2)C(C)C)cc1)C(O)=O
Show InChI InChI=1S/C24H28N2O5/c1-15(2)18-7-9-19(10-8-18)23-25-22(26-31-23)14-29-20-11-5-17(6-12-20)13-21(24(27)28)30-16(3)4/h5-12,15-16,21H,13-14H2,1-4H3,(H,27,28)
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n/an/an/an/a 7.90E+3n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity against human PPAR delta receptor in CV-1 cell was determined


Bioorg Med Chem Lett 11: 2385-8 (2001)


BindingDB Entry DOI: 10.7270/Q2CJ8CSF
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50103949
PNG
(2-Isopropoxy-3-{4-[5-(4-trifluoromethyl-phenyl)-[1...)
Show SMILES CC(C)OC(Cc1ccc(OCc2noc(n2)-c2ccc(cc2)C(F)(F)F)cc1)C(O)=O
Show InChI InChI=1S/C22H21F3N2O5/c1-13(2)31-18(21(28)29)11-14-3-9-17(10-4-14)30-12-19-26-20(32-27-19)15-5-7-16(8-6-15)22(23,24)25/h3-10,13,18H,11-12H2,1-2H3,(H,28,29)
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n/an/an/an/a 500n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity against human PPAR delta receptor in CV-1 cell was determined


Bioorg Med Chem Lett 11: 2385-8 (2001)


BindingDB Entry DOI: 10.7270/Q2CJ8CSF
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50103942
PNG
(3-(4-((5-cyclohexyl-1,2,4-oxadiazol-3-yl)methoxy)p...)
Show SMILES CC(C)OC(Cc1ccc(OCc2noc(n2)C2CCCCC2)cc1)C(O)=O
Show InChI InChI=1S/C21H28N2O5/c1-14(2)27-18(21(24)25)12-15-8-10-17(11-9-15)26-13-19-22-20(28-23-19)16-6-4-3-5-7-16/h8-11,14,16,18H,3-7,12-13H2,1-2H3,(H,24,25)
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n/an/an/an/a 230n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity against human Peroxisome proliferator activated receptor gamma receptor in CV-1 cell was determined


Bioorg Med Chem Lett 11: 2385-8 (2001)


BindingDB Entry DOI: 10.7270/Q2CJ8CSF
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50103946
PNG
(3-(4-((5-(3,5-difluorophenyl)-1,2,4-oxadiazol-3-yl...)
Show SMILES CC(C)OC(Cc1ccc(OCc2noc(n2)-c2cc(F)cc(F)c2)cc1)C(O)=O
Show InChI InChI=1S/C21H20F2N2O5/c1-12(2)29-18(21(26)27)7-13-3-5-17(6-4-13)28-11-19-24-20(30-25-19)14-8-15(22)10-16(23)9-14/h3-6,8-10,12,18H,7,11H2,1-2H3,(H,26,27)
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n/an/an/an/a 160n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity against human PPAR delta receptor in CV-1 cell was determined


Bioorg Med Chem Lett 11: 2385-8 (2001)


BindingDB Entry DOI: 10.7270/Q2CJ8CSF
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50103940
PNG
(3-(4-((5-(3,5-bis(trifluoromethyl)phenyl)-1,2,4-ox...)
Show SMILES CC(C)OC(Cc1ccc(OCc2noc(n2)-c2cc(cc(c2)C(F)(F)F)C(F)(F)F)cc1)C(O)=O
Show InChI InChI=1S/C23H20F6N2O5/c1-12(2)35-18(21(32)33)7-13-3-5-17(6-4-13)34-11-19-30-20(36-31-19)14-8-15(22(24,25)26)10-16(9-14)23(27,28)29/h3-6,8-10,12,18H,7,11H2,1-2H3,(H,32,33)
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n/an/an/an/a 32n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity against human Peroxisome proliferator activated receptor gamma receptor in CV-1 cell was determined


Bioorg Med Chem Lett 11: 2385-8 (2001)


BindingDB Entry DOI: 10.7270/Q2CJ8CSF
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50103948
PNG
(2-Isopropoxy-3-[4-(5-p-tolyl-[1,2,4]oxadiazol-3-yl...)
Show SMILES CC(C)OC(Cc1ccc(OCc2noc(n2)-c2ccc(C)cc2)cc1)C(O)=O
Show InChI InChI=1S/C22H24N2O5/c1-14(2)28-19(22(25)26)12-16-6-10-18(11-7-16)27-13-20-23-21(29-24-20)17-8-4-15(3)5-9-17/h4-11,14,19H,12-13H2,1-3H3,(H,25,26)
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n/an/an/an/a 2.50E+3n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity against human PPAR delta receptor in CV-1 cell was determined


Bioorg Med Chem Lett 11: 2385-8 (2001)


BindingDB Entry DOI: 10.7270/Q2CJ8CSF
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50103951
PNG
(3-(4-(2-(5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl)e...)
Show SMILES CC(C)OC(Cc1ccc(OCCc2noc(n2)-c2ccc(F)cc2)cc1)C(O)=O
Show InChI InChI=1S/C22H23FN2O5/c1-14(2)29-19(22(26)27)13-15-3-9-18(10-4-15)28-12-11-20-24-21(30-25-20)16-5-7-17(23)8-6-16/h3-10,14,19H,11-13H2,1-2H3,(H,26,27)
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n/an/an/an/a 40n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity against human Peroxisome proliferator activated receptor gamma receptor in CV-1 cell was determined


Bioorg Med Chem Lett 11: 2385-8 (2001)


BindingDB Entry DOI: 10.7270/Q2CJ8CSF
More data for this
Ligand-Target Pair
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