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PubMed code 22534184

Compile data set for download or QSAR
Found 87 hits of Enzyme Inhibition Constant Data   
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 gamma


(Homo sapiens (Human))
BDBM50384971
PNG
(CHEMBL2035069)
Show SMILES CCCC(Sc1ccc(OCC(O)=O)c(C)c1)c1sc(nc1C)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C24H24F3NO3S2/c1-4-5-20(32-18-10-11-19(14(2)12-18)31-13-21(29)30)22-15(3)28-23(33-22)16-6-8-17(9-7-16)24(25,26)27/h6-12,20H,4-5,13H2,1-3H3,(H,29,30)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARgamma expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50384993
PNG
(CHEMBL2037584)
Show SMILES Cc1nc(sc1C(Cc1ccc(cc1)[N+]([O-])=O)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C28H23F3N2O5S2/c1-16-13-22(11-12-23(16)38-15-25(34)35)39-24(14-18-3-9-21(10-4-18)33(36)37)26-17(2)32-27(40-26)19-5-7-20(8-6-19)28(29,30)31/h3-13,24H,14-15H2,1-2H3,(H,34,35)
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n/an/an/an/a 60n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARdelta expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM28661
PNG
(2-{2-methyl-4-[({4-methyl-2-[4-(trifluoromethyl)ph...)
Show SMILES Cc1nc(sc1CSc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C21H18F3NO3S2/c1-12-9-16(7-8-17(12)28-10-19(26)27)29-11-18-13(2)25-20(30-18)14-3-5-15(6-4-14)21(22,23)24/h3-9H,10-11H2,1-2H3,(H,26,27)
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n/an/an/an/a>1.20E+3n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARgamma expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50384987
PNG
(CHEMBL2035063)
Show SMILES Cc1nc(sc1C(Cc1c(F)c(F)c(F)c(F)c1F)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C28H19F8NO3S2/c1-12-9-16(7-8-18(12)40-11-20(38)39)41-19(10-17-21(29)23(31)25(33)24(32)22(17)30)26-13(2)37-27(42-26)14-3-5-15(6-4-14)28(34,35)36/h3-9,19H,10-11H2,1-2H3,(H,38,39)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARalpha expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50384994
PNG
(CHEMBL2037583)
Show SMILES Cc1nc(sc1C(CCCCCCCCCCc1ccccc1)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C37H42F3NO3S2/c1-26-24-31(22-23-32(26)44-25-34(42)43)45-33(17-13-8-6-4-3-5-7-10-14-28-15-11-9-12-16-28)35-27(2)41-36(46-35)29-18-20-30(21-19-29)37(38,39)40/h9,11-12,15-16,18-24,33H,3-8,10,13-14,17,25H2,1-2H3,(H,42,43)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARgamma expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50384988
PNG
(CHEMBL2037585)
Show SMILES Cc1nc(sc1C(Cc1ccc(cc1)C(F)(F)F)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C29H23F6NO3S2/c1-16-13-22(11-12-23(16)39-15-25(37)38)40-24(14-18-3-7-20(8-4-18)28(30,31)32)26-17(2)36-27(41-26)19-5-9-21(10-6-19)29(33,34)35/h3-13,24H,14-15H2,1-2H3,(H,37,38)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARgamma expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50384983
PNG
(CHEMBL2035060)
Show SMILES Cc1nc(sc1C(Cc1ccc(F)cc1F)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C28H22F5NO3S2/c1-15-11-21(9-10-23(15)37-14-25(35)36)38-24(12-18-5-8-20(29)13-22(18)30)26-16(2)34-27(39-26)17-3-6-19(7-4-17)28(31,32)33/h3-11,13,24H,12,14H2,1-2H3,(H,35,36)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARgamma expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50384982
PNG
(CHEMBL2035064)
Show SMILES Cc1nc(sc1C(Cc1ccc(cc1)-c1ccccc1)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C34H28F3NO3S2/c1-21-18-28(16-17-29(21)41-20-31(39)40)42-30(19-23-8-10-25(11-9-23)24-6-4-3-5-7-24)32-22(2)38-33(43-32)26-12-14-27(15-13-26)34(35,36)37/h3-18,30H,19-20H2,1-2H3,(H,39,40)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARgamma expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50384980
PNG
(CHEMBL2037578)
Show SMILES Cc1nc(sc1C(CCc1ccccc1)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C29H26F3NO3S2/c1-18-16-23(13-14-24(18)36-17-26(34)35)37-25(15-8-20-6-4-3-5-7-20)27-19(2)33-28(38-27)21-9-11-22(12-10-21)29(30,31)32/h3-7,9-14,16,25H,8,15,17H2,1-2H3,(H,34,35)
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n/an/an/an/a 2.60n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARdelta expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50384983
PNG
(CHEMBL2035060)
Show SMILES Cc1nc(sc1C(Cc1ccc(F)cc1F)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C28H22F5NO3S2/c1-15-11-21(9-10-23(15)37-14-25(35)36)38-24(12-18-5-8-20(29)13-22(18)30)26-16(2)34-27(39-26)17-3-6-19(7-4-17)28(31,32)33/h3-11,13,24H,12,14H2,1-2H3,(H,35,36)
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n/an/an/an/a 4.60n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARdelta expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50384976
PNG
(CHEMBL2037577)
Show SMILES Cc1nc(sc1C(Cc1ccccc1)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C28H24F3NO3S2/c1-17-14-22(12-13-23(17)35-16-25(33)34)36-24(15-19-6-4-3-5-7-19)26-18(2)32-27(37-26)20-8-10-21(11-9-20)28(29,30)31/h3-14,24H,15-16H2,1-2H3,(H,33,34)
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n/an/an/an/a 13n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Binding affinity at human GST-tagged PPARdelta ligand binding domain after 1 hr by time-resolved FRET analysis


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50384995
PNG
(CHEMBL2035065)
Show SMILES Cc1nc(sc1C(Cc1cccc2ccccc12)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C32H26F3NO3S2/c1-19-16-25(14-15-27(19)39-18-29(37)38)40-28(17-23-8-5-7-21-6-3-4-9-26(21)23)30-20(2)36-31(41-30)22-10-12-24(13-11-22)32(33,34)35/h3-16,28H,17-18H2,1-2H3,(H,37,38)
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n/an/an/an/a 490n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARdelta expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50384972
PNG
(CHEMBL2035071)
Show SMILES CC(C)CC(Sc1ccc(OCC(O)=O)c(C)c1)c1sc(nc1C)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C25H26F3NO3S2/c1-14(2)11-21(33-19-9-10-20(15(3)12-19)32-13-22(30)31)23-16(4)29-24(34-23)17-5-7-18(8-6-17)25(26,27)28/h5-10,12,14,21H,11,13H2,1-4H3,(H,30,31)
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n/an/an/an/a 592n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARalpha expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50384985
PNG
(CHEMBL2037579)
Show SMILES Cc1nc(sc1C(CCCc1ccccc1)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C30H28F3NO3S2/c1-19-17-24(15-16-25(19)37-18-27(35)36)38-26(10-6-9-21-7-4-3-5-8-21)28-20(2)34-29(39-28)22-11-13-23(14-12-22)30(31,32)33/h3-5,7-8,11-17,26H,6,9-10,18H2,1-2H3,(H,35,36)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARalpha expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50384989
PNG
(CHEMBL2037581)
Show SMILES Cc1nc(sc1C(CCCCCc1ccccc1)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C32H32F3NO3S2/c1-21-19-26(17-18-27(21)39-20-29(37)38)40-28(12-8-4-7-11-23-9-5-3-6-10-23)30-22(2)36-31(41-30)24-13-15-25(16-14-24)32(33,34)35/h3,5-6,9-10,13-19,28H,4,7-8,11-12,20H2,1-2H3,(H,37,38)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARalpha expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50384974
PNG
(CHEMBL2037587)
Show SMILES Cc1nc(sc1C(Cc1c(F)cccc1Cl)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C28H22ClF4NO3S2/c1-15-12-19(10-11-23(15)37-14-25(35)36)38-24(13-20-21(29)4-3-5-22(20)30)26-16(2)34-27(39-26)17-6-8-18(9-7-17)28(31,32)33/h3-12,24H,13-14H2,1-2H3,(H,35,36)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARalpha expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50384997
PNG
(CHEMBL2035066)
Show SMILES Cc1nc(sc1C(Cc1c2ccccc2cc2ccccc12)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C36H28F3NO3S2/c1-21-17-27(15-16-31(21)43-20-33(41)42)44-32(19-30-28-9-5-3-7-24(28)18-25-8-4-6-10-29(25)30)34-22(2)40-35(45-34)23-11-13-26(14-12-23)36(37,38)39/h3-18,32H,19-20H2,1-2H3,(H,41,42)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARalpha expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50384974
PNG
(CHEMBL2037587)
Show SMILES Cc1nc(sc1C(Cc1c(F)cccc1Cl)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C28H22ClF4NO3S2/c1-15-12-19(10-11-23(15)37-14-25(35)36)38-24(13-20-21(29)4-3-5-22(20)30)26-16(2)34-27(39-26)17-6-8-18(9-7-17)28(31,32)33/h3-12,24H,13-14H2,1-2H3,(H,35,36)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARgamma expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50384996
PNG
(CHEMBL2035067)
Show SMILES Cc1nc(sc1C(Sc1ccc(OCC(O)=O)c(C)c1)C(c1ccccc1)c1ccccc1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C34H28F3NO3S2/c1-21-19-27(17-18-28(21)41-20-29(39)40)42-32(30(23-9-5-3-6-10-23)24-11-7-4-8-12-24)31-22(2)38-33(43-31)25-13-15-26(16-14-25)34(35,36)37/h3-19,30,32H,20H2,1-2H3,(H,39,40)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARgamma expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM28661
PNG
(2-{2-methyl-4-[({4-methyl-2-[4-(trifluoromethyl)ph...)
Show SMILES Cc1nc(sc1CSc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C21H18F3NO3S2/c1-12-9-16(7-8-17(12)28-10-19(26)27)29-11-18-13(2)25-20(30-18)14-3-5-15(6-4-14)21(22,23)24/h3-9H,10-11H2,1-2H3,(H,26,27)
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n/an/an/an/a 24n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Binding affinity at human GST-tagged PPARdelta ligand binding domain after 1 hr by time-resolved FRET analysis


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50384974
PNG
(CHEMBL2037587)
Show SMILES Cc1nc(sc1C(Cc1c(F)cccc1Cl)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C28H22ClF4NO3S2/c1-15-12-19(10-11-23(15)37-14-25(35)36)38-24(13-20-21(29)4-3-5-22(20)30)26-16(2)34-27(39-26)17-6-8-18(9-7-17)28(31,32)33/h3-12,24H,13-14H2,1-2H3,(H,35,36)
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n/an/an/an/a 1.20n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARdelta expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50384986
PNG
(CHEMBL2035062)
Show SMILES Cc1nc(sc1C(Cc1cc(F)c(F)c(F)c1)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C28H21F6NO3S2/c1-14-9-19(7-8-22(14)38-13-24(36)37)39-23(12-16-10-20(29)25(31)21(30)11-16)26-15(2)35-27(40-26)17-3-5-18(6-4-17)28(32,33)34/h3-11,23H,12-13H2,1-2H3,(H,36,37)
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n/an/an/an/a 6.70n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARdelta expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50384996
PNG
(CHEMBL2035067)
Show SMILES Cc1nc(sc1C(Sc1ccc(OCC(O)=O)c(C)c1)C(c1ccccc1)c1ccccc1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C34H28F3NO3S2/c1-21-19-27(17-18-28(21)41-20-29(39)40)42-32(30(23-9-5-3-6-10-23)24-11-7-4-8-12-24)31-22(2)38-33(43-31)25-13-15-26(16-14-25)34(35,36)37/h3-19,30,32H,20H2,1-2H3,(H,39,40)
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n/an/an/an/a 523n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARdelta expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50384976
PNG
(CHEMBL2037577)
Show SMILES Cc1nc(sc1C(Cc1ccccc1)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C28H24F3NO3S2/c1-17-14-22(12-13-23(17)35-16-25(33)34)36-24(15-19-6-4-3-5-7-19)26-18(2)32-27(37-26)20-8-10-21(11-9-20)28(29,30)31/h3-14,24H,15-16H2,1-2H3,(H,33,34)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARalpha expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50384980
PNG
(CHEMBL2037578)
Show SMILES Cc1nc(sc1C(CCc1ccccc1)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C29H26F3NO3S2/c1-18-16-23(13-14-24(18)36-17-26(34)35)37-25(15-8-20-6-4-3-5-7-20)27-19(2)33-28(38-27)21-9-11-22(12-10-21)29(30,31)32/h3-7,9-14,16,25H,8,15,17H2,1-2H3,(H,34,35)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARalpha expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50384995
PNG
(CHEMBL2035065)
Show SMILES Cc1nc(sc1C(Cc1cccc2ccccc12)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C32H26F3NO3S2/c1-19-16-25(14-15-27(19)39-18-29(37)38)40-28(17-23-8-5-7-21-6-3-4-9-26(21)23)30-20(2)36-31(41-30)22-10-12-24(13-11-22)32(33,34)35/h3-16,28H,17-18H2,1-2H3,(H,37,38)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARalpha expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50384992
PNG
(CHEMBL2037582)
Show SMILES Cc1nc(sc1C(CCCCCCCc1ccccc1)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C34H36F3NO3S2/c1-23-21-28(19-20-29(23)41-22-31(39)40)42-30(14-10-5-3-4-7-11-25-12-8-6-9-13-25)32-24(2)38-33(43-32)26-15-17-27(18-16-26)34(35,36)37/h6,8-9,12-13,15-21,30H,3-5,7,10-11,14,22H2,1-2H3,(H,39,40)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARgamma expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50384981
PNG
(CHEMBL2035059)
Show SMILES Cc1nc(sc1C(Cc1c(Cl)cccc1Cl)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C28H22Cl2F3NO3S2/c1-15-12-19(10-11-23(15)37-14-25(35)36)38-24(13-20-21(29)4-3-5-22(20)30)26-16(2)34-27(39-26)17-6-8-18(9-7-17)28(31,32)33/h3-12,24H,13-14H2,1-2H3,(H,35,36)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARgamma expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50384986
PNG
(CHEMBL2035062)
Show SMILES Cc1nc(sc1C(Cc1cc(F)c(F)c(F)c1)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C28H21F6NO3S2/c1-14-9-19(7-8-22(14)38-13-24(36)37)39-23(12-16-10-20(29)25(31)21(30)11-16)26-15(2)35-27(40-26)17-3-5-18(6-4-17)28(32,33)34/h3-11,23H,12-13H2,1-2H3,(H,36,37)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARgamma expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50384979
PNG
(CHEMBL2035070)
Show SMILES CCCCC(Sc1ccc(OCC(O)=O)c(C)c1)c1sc(nc1C)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C25H26F3NO3S2/c1-4-5-6-21(33-19-11-12-20(15(2)13-19)32-14-22(30)31)23-16(3)29-24(34-23)17-7-9-18(10-8-17)25(26,27)28/h7-13,21H,4-6,14H2,1-3H3,(H,30,31)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARgamma expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50384975
PNG
(CHEMBL2035058)
Show SMILES Cc1nc(sc1C(Cc1c(F)cccc1C(F)(F)F)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C29H22F7NO3S2/c1-15-12-19(10-11-23(15)40-14-25(38)39)41-24(13-20-21(29(34,35)36)4-3-5-22(20)30)26-16(2)37-27(42-26)17-6-8-18(9-7-17)28(31,32)33/h3-12,24H,13-14H2,1-2H3,(H,38,39)
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n/an/an/an/a 1.20n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARdelta expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50384976
PNG
(CHEMBL2037577)
Show SMILES Cc1nc(sc1C(Cc1ccccc1)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C28H24F3NO3S2/c1-17-14-22(12-13-23(17)35-16-25(33)34)36-24(15-19-6-4-3-5-7-19)26-18(2)32-27(37-26)20-8-10-21(11-9-20)28(29,30)31/h3-14,24H,15-16H2,1-2H3,(H,33,34)
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n/an/an/an/a 1.60n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARdelta expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50384977
PNG
(CHEMBL2035068)
Show SMILES CCC(Sc1ccc(OCC(O)=O)c(C)c1)c1sc(nc1C)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C23H22F3NO3S2/c1-4-19(31-17-9-10-18(13(2)11-17)30-12-20(28)29)21-14(3)27-22(32-21)15-5-7-16(8-6-15)23(24,25)26/h5-11,19H,4,12H2,1-3H3,(H,28,29)
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n/an/an/an/a 1.80n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARdelta expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50384978
PNG
(CHEMBL2037588)
Show SMILES Cc1nc(sc1C(Cc1c(F)cccc1F)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C28H22F5NO3S2/c1-15-12-19(10-11-23(15)37-14-25(35)36)38-24(13-20-21(29)4-3-5-22(20)30)26-16(2)34-27(39-26)17-6-8-18(9-7-17)28(31,32)33/h3-12,24H,13-14H2,1-2H3,(H,35,36)
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n/an/an/an/a 2.10n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARdelta expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50384984
PNG
(CHEMBL2037586)
Show SMILES COc1ccc(CC(Sc2ccc(OCC(O)=O)c(C)c2)c2sc(nc2C)-c2ccc(cc2)C(F)(F)F)cc1
Show InChI InChI=1S/C29H26F3NO4S2/c1-17-14-23(12-13-24(17)37-16-26(34)35)38-25(15-19-4-10-22(36-3)11-5-19)27-18(2)33-28(39-27)20-6-8-21(9-7-20)29(30,31)32/h4-14,25H,15-16H2,1-3H3,(H,34,35)
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n/an/an/an/a 4.80n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARdelta expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50384987
PNG
(CHEMBL2035063)
Show SMILES Cc1nc(sc1C(Cc1c(F)c(F)c(F)c(F)c1F)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C28H19F8NO3S2/c1-12-9-16(7-8-18(12)40-11-20(38)39)41-19(10-17-21(29)23(31)25(33)24(32)22(17)30)26-13(2)37-27(42-26)14-3-5-15(6-4-14)28(34,35)36/h3-9,19H,10-11H2,1-2H3,(H,38,39)
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n/an/an/an/a 8.10n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARdelta expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50384973
PNG
(CHEMBL2035057)
Show SMILES Cc1nc(sc1C(CC1CC1)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C25H24F3NO3S2/c1-14-11-19(9-10-20(14)32-13-22(30)31)33-21(12-16-3-4-16)23-15(2)29-24(34-23)17-5-7-18(8-6-17)25(26,27)28/h5-11,16,21H,3-4,12-13H2,1-2H3,(H,30,31)
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n/an/an/an/a 861n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARalpha expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM28661
PNG
(2-{2-methyl-4-[({4-methyl-2-[4-(trifluoromethyl)ph...)
Show SMILES Cc1nc(sc1CSc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C21H18F3NO3S2/c1-12-9-16(7-8-17(12)28-10-19(26)27)29-11-18-13(2)25-20(30-18)14-3-5-15(6-4-14)21(22,23)24/h3-9H,10-11H2,1-2H3,(H,26,27)
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n/an/an/an/a 229n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARalpha expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50384991
PNG
(CHEMBL2037580)
Show SMILES Cc1nc(sc1C(CCCCc1ccccc1)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C31H30F3NO3S2/c1-20-18-25(16-17-26(20)38-19-28(36)37)39-27(11-7-6-10-22-8-4-3-5-9-22)29-21(2)35-30(40-29)23-12-14-24(15-13-23)31(32,33)34/h3-5,8-9,12-18,27H,6-7,10-11,19H2,1-2H3,(H,36,37)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARalpha expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50384984
PNG
(CHEMBL2037586)
Show SMILES COc1ccc(CC(Sc2ccc(OCC(O)=O)c(C)c2)c2sc(nc2C)-c2ccc(cc2)C(F)(F)F)cc1
Show InChI InChI=1S/C29H26F3NO4S2/c1-17-14-23(12-13-24(17)37-16-26(34)35)38-25(15-19-4-10-22(36-3)11-5-19)27-18(2)33-28(39-27)20-6-8-21(9-7-20)29(30,31)32/h4-14,25H,15-16H2,1-3H3,(H,34,35)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARalpha expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50384978
PNG
(CHEMBL2037588)
Show SMILES Cc1nc(sc1C(Cc1c(F)cccc1F)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C28H22F5NO3S2/c1-15-12-19(10-11-23(15)37-14-25(35)36)38-24(13-20-21(29)4-3-5-22(20)30)26-16(2)34-27(39-26)17-6-8-18(9-7-17)28(31,32)33/h3-12,24H,13-14H2,1-2H3,(H,35,36)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARalpha expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50384980
PNG
(CHEMBL2037578)
Show SMILES Cc1nc(sc1C(CCc1ccccc1)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C29H26F3NO3S2/c1-18-16-23(13-14-24(18)36-17-26(34)35)37-25(15-8-20-6-4-3-5-7-20)27-19(2)33-28(38-27)21-9-11-22(12-10-21)29(30,31)32/h3-7,9-14,16,25H,8,15,17H2,1-2H3,(H,34,35)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARgamma expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50384984
PNG
(CHEMBL2037586)
Show SMILES COc1ccc(CC(Sc2ccc(OCC(O)=O)c(C)c2)c2sc(nc2C)-c2ccc(cc2)C(F)(F)F)cc1
Show InChI InChI=1S/C29H26F3NO4S2/c1-17-14-23(12-13-24(17)37-16-26(34)35)38-25(15-19-4-10-22(36-3)11-5-19)27-18(2)33-28(39-27)20-6-8-21(9-7-20)29(30,31)32/h4-14,25H,15-16H2,1-3H3,(H,34,35)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARgamma expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50384977
PNG
(CHEMBL2035068)
Show SMILES CCC(Sc1ccc(OCC(O)=O)c(C)c1)c1sc(nc1C)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C23H22F3NO3S2/c1-4-19(31-17-9-10-18(13(2)11-17)30-12-20(28)29)21-14(3)27-22(32-21)15-5-7-16(8-6-15)23(24,25)26/h5-11,19H,4,12H2,1-3H3,(H,28,29)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARgamma expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50384973
PNG
(CHEMBL2035057)
Show SMILES Cc1nc(sc1C(CC1CC1)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C25H24F3NO3S2/c1-14-11-19(9-10-20(14)32-13-22(30)31)33-21(12-16-3-4-16)23-15(2)29-24(34-23)17-5-7-18(8-6-17)25(26,27)28/h5-11,16,21H,3-4,12-13H2,1-2H3,(H,30,31)
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n/an/an/an/a 1.10n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARdelta expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50384981
PNG
(CHEMBL2035059)
Show SMILES Cc1nc(sc1C(Cc1c(Cl)cccc1Cl)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C28H22Cl2F3NO3S2/c1-15-12-19(10-11-23(15)37-14-25(35)36)38-24(13-20-21(29)4-3-5-22(20)30)26-16(2)34-27(39-26)17-6-8-18(9-7-17)28(31,32)33/h3-12,24H,13-14H2,1-2H3,(H,35,36)
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n/an/an/an/a 2.80n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARdelta expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50384990
PNG
(CHEMBL2035061)
Show SMILES Cc1nc(sc1C(Cc1cc(F)ccc1F)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C28H22F5NO3S2/c1-15-11-21(8-10-23(15)37-14-25(35)36)38-24(13-18-12-20(29)7-9-22(18)30)26-16(2)34-27(39-26)17-3-5-19(6-4-17)28(31,32)33/h3-12,24H,13-14H2,1-2H3,(H,35,36)
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n/an/an/an/a 16.7n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARdelta expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50384994
PNG
(CHEMBL2037583)
Show SMILES Cc1nc(sc1C(CCCCCCCCCCc1ccccc1)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C37H42F3NO3S2/c1-26-24-31(22-23-32(26)44-25-34(42)43)45-33(17-13-8-6-4-3-5-7-10-14-28-15-11-9-12-16-28)35-27(2)41-36(46-35)29-18-20-30(21-19-29)37(38,39)40/h9,11-12,15-16,18-24,33H,3-8,10,13-14,17,25H2,1-2H3,(H,42,43)
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n/an/an/an/a 132n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARdelta expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50384977
PNG
(CHEMBL2035068)
Show SMILES CCC(Sc1ccc(OCC(O)=O)c(C)c1)c1sc(nc1C)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C23H22F3NO3S2/c1-4-19(31-17-9-10-18(13(2)11-17)30-12-20(28)29)21-14(3)27-22(32-21)15-5-7-16(8-6-15)23(24,25)26/h5-11,19H,4,12H2,1-3H3,(H,28,29)
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n/an/an/an/a 136n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARalpha expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50384975
PNG
(CHEMBL2035058)
Show SMILES Cc1nc(sc1C(Cc1c(F)cccc1C(F)(F)F)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C29H22F7NO3S2/c1-15-12-19(10-11-23(15)40-14-25(38)39)41-24(13-20-21(29(34,35)36)4-3-5-22(20)30)26-16(2)37-27(42-26)17-6-8-18(9-7-17)28(31,32)33/h3-12,24H,13-14H2,1-2H3,(H,38,39)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARalpha expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50384986
PNG
(CHEMBL2035062)
Show SMILES Cc1nc(sc1C(Cc1cc(F)c(F)c(F)c1)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C28H21F6NO3S2/c1-14-9-19(7-8-22(14)38-13-24(36)37)39-23(12-16-10-20(29)25(31)21(30)11-16)26-15(2)35-27(40-26)17-3-5-18(6-4-17)28(32,33)34/h3-11,23H,12-13H2,1-2H3,(H,36,37)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARalpha expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50384996
PNG
(CHEMBL2035067)
Show SMILES Cc1nc(sc1C(Sc1ccc(OCC(O)=O)c(C)c1)C(c1ccccc1)c1ccccc1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C34H28F3NO3S2/c1-21-19-27(17-18-28(21)41-20-29(39)40)42-32(30(23-9-5-3-6-10-23)24-11-7-4-8-12-24)31-22(2)38-33(43-31)25-13-15-26(16-14-25)34(35,36)37/h3-19,30,32H,20H2,1-2H3,(H,39,40)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARalpha expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50384991
PNG
(CHEMBL2037580)
Show SMILES Cc1nc(sc1C(CCCCc1ccccc1)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C31H30F3NO3S2/c1-20-18-25(16-17-26(20)38-19-28(36)37)39-27(11-7-6-10-22-8-4-3-5-9-22)29-21(2)35-30(40-29)23-12-14-24(15-13-23)31(32,33)34/h3-5,8-9,12-18,27H,6-7,10-11,19H2,1-2H3,(H,36,37)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARgamma expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50384975
PNG
(CHEMBL2035058)
Show SMILES Cc1nc(sc1C(Cc1c(F)cccc1C(F)(F)F)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C29H22F7NO3S2/c1-15-12-19(10-11-23(15)40-14-25(38)39)41-24(13-20-21(29(34,35)36)4-3-5-22(20)30)26-16(2)37-27(42-26)17-6-8-18(9-7-17)28(31,32)33/h3-12,24H,13-14H2,1-2H3,(H,38,39)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARgamma expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50384997
PNG
(CHEMBL2035066)
Show SMILES Cc1nc(sc1C(Cc1c2ccccc2cc2ccccc12)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C36H28F3NO3S2/c1-21-17-27(15-16-31(21)43-20-33(41)42)44-32(19-30-28-9-5-3-7-24(28)18-25-8-4-6-10-29(25)30)34-22(2)40-35(45-34)23-11-13-26(14-12-23)36(37,38)39/h3-18,32H,19-20H2,1-2H3,(H,41,42)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARgamma expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50384972
PNG
(CHEMBL2035071)
Show SMILES CC(C)CC(Sc1ccc(OCC(O)=O)c(C)c1)c1sc(nc1C)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C25H26F3NO3S2/c1-14(2)11-21(33-19-9-10-20(15(3)12-19)32-13-22(30)31)23-16(4)29-24(34-23)17-5-7-18(8-6-17)25(26,27)28/h5-10,12,14,21H,11,13H2,1-4H3,(H,30,31)
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n/an/an/an/a 1.10n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARdelta expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50384979
PNG
(CHEMBL2035070)
Show SMILES CCCCC(Sc1ccc(OCC(O)=O)c(C)c1)c1sc(nc1C)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C25H26F3NO3S2/c1-4-5-6-21(33-19-11-12-20(15(2)13-19)32-14-22(30)31)23-16(3)29-24(34-23)17-7-9-18(10-8-17)25(26,27)28/h7-13,21H,4-6,14H2,1-3H3,(H,30,31)
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n/an/an/an/a 2.30n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARdelta expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50384982
PNG
(CHEMBL2035064)
Show SMILES Cc1nc(sc1C(Cc1ccc(cc1)-c1ccccc1)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C34H28F3NO3S2/c1-21-18-28(16-17-29(21)41-20-31(39)40)42-30(19-23-8-10-25(11-9-23)24-6-4-3-5-7-24)32-22(2)38-33(43-32)26-12-14-27(15-13-26)34(35,36)37/h3-18,30H,19-20H2,1-2H3,(H,39,40)
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n/an/an/an/a 4.40n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARdelta expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50384992
PNG
(CHEMBL2037582)
Show SMILES Cc1nc(sc1C(CCCCCCCc1ccccc1)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C34H36F3NO3S2/c1-23-21-28(19-20-29(23)41-22-31(39)40)42-30(14-10-5-3-4-7-11-25-12-8-6-9-13-25)32-24(2)38-33(43-32)26-15-17-27(18-16-26)34(35,36)37/h6,8-9,12-13,15-21,30H,3-5,7,10-11,14,22H2,1-2H3,(H,39,40)
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n/an/an/an/a 57.2n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARdelta expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50384981
PNG
(CHEMBL2035059)
Show SMILES Cc1nc(sc1C(Cc1c(Cl)cccc1Cl)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C28H22Cl2F3NO3S2/c1-15-12-19(10-11-23(15)37-14-25(35)36)38-24(13-20-21(29)4-3-5-22(20)30)26-16(2)34-27(39-26)17-6-8-18(9-7-17)28(31,32)33/h3-12,24H,13-14H2,1-2H3,(H,35,36)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARalpha expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50384982
PNG
(CHEMBL2035064)
Show SMILES Cc1nc(sc1C(Cc1ccc(cc1)-c1ccccc1)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C34H28F3NO3S2/c1-21-18-28(16-17-29(21)41-20-31(39)40)42-30(19-23-8-10-25(11-9-23)24-6-4-3-5-7-24)32-22(2)38-33(43-32)26-12-14-27(15-13-26)34(35,36)37/h3-18,30H,19-20H2,1-2H3,(H,39,40)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARalpha expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50384989
PNG
(CHEMBL2037581)
Show SMILES Cc1nc(sc1C(CCCCCc1ccccc1)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C32H32F3NO3S2/c1-21-19-26(17-18-27(21)39-20-29(37)38)40-28(12-8-4-7-11-23-9-5-3-6-10-23)30-22(2)36-31(41-30)24-13-15-25(16-14-24)32(33,34)35/h3,5-6,9-10,13-19,28H,4,7-8,11-12,20H2,1-2H3,(H,37,38)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARgamma expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50384995
PNG
(CHEMBL2035065)
Show SMILES Cc1nc(sc1C(Cc1cccc2ccccc12)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C32H26F3NO3S2/c1-19-16-25(14-15-27(19)39-18-29(37)38)40-28(17-23-8-5-7-21-6-3-4-9-26(21)23)30-20(2)36-31(41-30)22-10-12-24(13-11-22)32(33,34)35/h3-16,28H,17-18H2,1-2H3,(H,37,38)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARgamma expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50384972
PNG
(CHEMBL2035071)
Show SMILES CC(C)CC(Sc1ccc(OCC(O)=O)c(C)c1)c1sc(nc1C)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C25H26F3NO3S2/c1-14(2)11-21(33-19-9-10-20(15(3)12-19)32-13-22(30)31)23-16(4)29-24(34-23)17-5-7-18(8-6-17)25(26,27)28/h5-10,12,14,21H,11,13H2,1-4H3,(H,30,31)
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Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARgamma expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50384973
PNG
(CHEMBL2035057)
Show SMILES Cc1nc(sc1C(CC1CC1)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C25H24F3NO3S2/c1-14-11-19(9-10-20(14)32-13-22(30)31)33-21(12-16-3-4-16)23-15(2)29-24(34-23)17-5-7-18(8-6-17)25(26,27)28/h5-11,16,21H,3-4,12-13H2,1-2H3,(H,30,31)
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Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARgamma expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50384993
PNG
(CHEMBL2037584)
Show SMILES Cc1nc(sc1C(Cc1ccc(cc1)[N+]([O-])=O)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C28H23F3N2O5S2/c1-16-13-22(11-12-23(16)38-15-25(34)35)39-24(14-18-3-9-21(10-4-18)33(36)37)26-17(2)32-27(40-26)19-5-7-20(8-6-19)28(29,30)31/h3-13,24H,14-15H2,1-2H3,(H,34,35)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARalpha expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM28661
PNG
(2-{2-methyl-4-[({4-methyl-2-[4-(trifluoromethyl)ph...)
Show SMILES Cc1nc(sc1CSc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C21H18F3NO3S2/c1-12-9-16(7-8-17(12)28-10-19(26)27)29-11-18-13(2)25-20(30-18)14-3-5-15(6-4-14)21(22,23)24/h3-9H,10-11H2,1-2H3,(H,26,27)
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n/an/an/an/a 2.5n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARdelta expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50384985
PNG
(CHEMBL2037579)
Show SMILES Cc1nc(sc1C(CCCc1ccccc1)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C30H28F3NO3S2/c1-19-17-24(15-16-25(19)37-18-27(35)36)38-26(10-6-9-21-7-4-3-5-8-21)28-20(2)34-29(39-28)22-11-13-23(14-12-22)30(31,32)33/h3-5,7-8,11-17,26H,6,9-10,18H2,1-2H3,(H,35,36)
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n/an/an/an/a 6.10n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARdelta expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50384988
PNG
(CHEMBL2037585)
Show SMILES Cc1nc(sc1C(Cc1ccc(cc1)C(F)(F)F)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C29H23F6NO3S2/c1-16-13-22(11-12-23(16)39-15-25(37)38)40-24(14-18-3-7-20(8-4-18)28(30,31)32)26-17(2)36-27(41-26)19-5-9-21(10-6-19)29(33,34)35/h3-13,24H,14-15H2,1-2H3,(H,37,38)
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n/an/an/an/a 9.40n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARdelta expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50384983
PNG
(CHEMBL2035060)
Show SMILES Cc1nc(sc1C(Cc1ccc(F)cc1F)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C28H22F5NO3S2/c1-15-11-21(9-10-23(15)37-14-25(35)36)38-24(12-18-5-8-20(29)13-22(18)30)26-16(2)34-27(39-26)17-3-6-19(7-4-17)28(31,32)33/h3-11,13,24H,12,14H2,1-2H3,(H,35,36)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARalpha expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50384990
PNG
(CHEMBL2035061)
Show SMILES Cc1nc(sc1C(Cc1cc(F)ccc1F)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C28H22F5NO3S2/c1-15-11-21(8-10-23(15)37-14-25(35)36)38-24(13-18-12-20(29)7-9-22(18)30)26-16(2)34-27(39-26)17-3-5-19(6-4-17)28(31,32)33/h3-12,24H,13-14H2,1-2H3,(H,35,36)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARalpha expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50384976
PNG
(CHEMBL2037577)
Show SMILES Cc1nc(sc1C(Cc1ccccc1)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C28H24F3NO3S2/c1-17-14-22(12-13-23(17)35-16-25(33)34)36-24(15-19-6-4-3-5-7-19)26-18(2)32-27(37-26)20-8-10-21(11-9-20)28(29,30)31/h3-14,24H,15-16H2,1-2H3,(H,33,34)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARgamma expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50384985
PNG
(CHEMBL2037579)
Show SMILES Cc1nc(sc1C(CCCc1ccccc1)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C30H28F3NO3S2/c1-19-17-24(15-16-25(19)37-18-27(35)36)38-26(10-6-9-21-7-4-3-5-8-21)28-20(2)34-29(39-28)22-11-13-23(14-12-22)30(31,32)33/h3-5,7-8,11-17,26H,6,9-10,18H2,1-2H3,(H,35,36)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARgamma expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50384978
PNG
(CHEMBL2037588)
Show SMILES Cc1nc(sc1C(Cc1c(F)cccc1F)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C28H22F5NO3S2/c1-15-12-19(10-11-23(15)37-14-25(35)36)38-24(13-20-21(29)4-3-5-22(20)30)26-16(2)34-27(39-26)17-6-8-18(9-7-17)28(31,32)33/h3-12,24H,13-14H2,1-2H3,(H,35,36)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARgamma expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50384990
PNG
(CHEMBL2035061)
Show SMILES Cc1nc(sc1C(Cc1cc(F)ccc1F)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C28H22F5NO3S2/c1-15-11-21(8-10-23(15)37-14-25(35)36)38-24(13-18-12-20(29)7-9-22(18)30)26-16(2)34-27(39-26)17-3-5-19(6-4-17)28(31,32)33/h3-12,24H,13-14H2,1-2H3,(H,35,36)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARgamma expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50384971
PNG
(CHEMBL2035069)
Show SMILES CCCC(Sc1ccc(OCC(O)=O)c(C)c1)c1sc(nc1C)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C24H24F3NO3S2/c1-4-5-20(32-18-10-11-19(14(2)12-18)31-13-21(29)30)22-15(3)28-23(33-22)16-6-8-17(9-7-16)24(25,26)27/h6-12,20H,4-5,13H2,1-3H3,(H,29,30)
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n/an/an/an/a 1n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARdelta expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50384989
PNG
(CHEMBL2037581)
Show SMILES Cc1nc(sc1C(CCCCCc1ccccc1)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C32H32F3NO3S2/c1-21-19-26(17-18-27(21)39-20-29(37)38)40-28(12-8-4-7-11-23-9-5-3-6-10-23)30-22(2)36-31(41-30)24-13-15-25(16-14-24)32(33,34)35/h3,5-6,9-10,13-19,28H,4,7-8,11-12,20H2,1-2H3,(H,37,38)
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n/an/an/an/a 11.4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARdelta expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50384991
PNG
(CHEMBL2037580)
Show SMILES Cc1nc(sc1C(CCCCc1ccccc1)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C31H30F3NO3S2/c1-20-18-25(16-17-26(20)38-19-28(36)37)39-27(11-7-6-10-22-8-4-3-5-9-22)29-21(2)35-30(40-29)23-12-14-24(15-13-23)31(32,33)34/h3-5,8-9,12-18,27H,6-7,10-11,19H2,1-2H3,(H,36,37)
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n/an/an/an/a 38.8n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARdelta expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50384971
PNG
(CHEMBL2035069)
Show SMILES CCCC(Sc1ccc(OCC(O)=O)c(C)c1)c1sc(nc1C)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C24H24F3NO3S2/c1-4-5-20(32-18-10-11-19(14(2)12-18)31-13-21(29)30)22-15(3)28-23(33-22)16-6-8-17(9-7-16)24(25,26)27/h6-12,20H,4-5,13H2,1-3H3,(H,29,30)
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n/an/an/an/a 35n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARalpha expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50384979
PNG
(CHEMBL2035070)
Show SMILES CCCCC(Sc1ccc(OCC(O)=O)c(C)c1)c1sc(nc1C)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C25H26F3NO3S2/c1-4-5-6-21(33-19-11-12-20(15(2)13-19)32-14-22(30)31)23-16(3)29-24(34-23)17-7-9-18(10-8-17)25(26,27)28/h7-13,21H,4-6,14H2,1-3H3,(H,30,31)
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n/an/an/an/a 432n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARalpha expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50384992
PNG
(CHEMBL2037582)
Show SMILES Cc1nc(sc1C(CCCCCCCc1ccccc1)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C34H36F3NO3S2/c1-23-21-28(19-20-29(23)41-22-31(39)40)42-30(14-10-5-3-4-7-11-25-12-8-6-9-13-25)32-24(2)38-33(43-32)26-15-17-27(18-16-26)34(35,36)37/h6,8-9,12-13,15-21,30H,3-5,7,10-11,14,22H2,1-2H3,(H,39,40)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARalpha expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50384994
PNG
(CHEMBL2037583)
Show SMILES Cc1nc(sc1C(CCCCCCCCCCc1ccccc1)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C37H42F3NO3S2/c1-26-24-31(22-23-32(26)44-25-34(42)43)45-33(17-13-8-6-4-3-5-7-10-14-28-15-11-9-12-16-28)35-27(2)41-36(46-35)29-18-20-30(21-19-29)37(38,39)40/h9,11-12,15-16,18-24,33H,3-8,10,13-14,17,25H2,1-2H3,(H,42,43)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARalpha expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50384988
PNG
(CHEMBL2037585)
Show SMILES Cc1nc(sc1C(Cc1ccc(cc1)C(F)(F)F)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C29H23F6NO3S2/c1-16-13-22(11-12-23(16)39-15-25(37)38)40-24(14-18-3-7-20(8-4-18)28(30,31)32)26-17(2)36-27(41-26)19-5-9-21(10-6-19)29(33,34)35/h3-13,24H,14-15H2,1-2H3,(H,37,38)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARalpha expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50384993
PNG
(CHEMBL2037584)
Show SMILES Cc1nc(sc1C(Cc1ccc(cc1)[N+]([O-])=O)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C28H23F3N2O5S2/c1-16-13-22(11-12-23(16)38-15-25(34)35)39-24(14-18-3-9-21(10-4-18)33(36)37)26-17(2)32-27(40-26)19-5-7-20(8-6-19)28(29,30)31/h3-13,24H,14-15H2,1-2H3,(H,34,35)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARgamma expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50384987
PNG
(CHEMBL2035063)
Show SMILES Cc1nc(sc1C(Cc1c(F)c(F)c(F)c(F)c1F)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C28H19F8NO3S2/c1-12-9-16(7-8-18(12)40-11-20(38)39)41-19(10-17-21(29)23(31)25(33)24(32)22(17)30)26-13(2)37-27(42-26)14-3-5-15(6-4-14)28(34,35)36/h3-9,19H,10-11H2,1-2H3,(H,38,39)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARgamma expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50085040
PNG
(CHEMBL278994 | L-796449 | {3-Chloro-4-[3-(3-phenyl...)
Show SMILES CCCc1c(OCCCSc2ccc(CC(O)=O)cc2Cl)ccc2c(coc12)-c1ccccc1
Show InChI InChI=1S/C28H27ClO4S/c1-2-7-22-25(12-11-21-23(18-33-28(21)22)20-8-4-3-5-9-20)32-14-6-15-34-26-13-10-19(16-24(26)29)17-27(30)31/h3-5,8-13,16,18H,2,6-7,14-15,17H2,1H3,(H,30,31)
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n/an/an/an/a 7.90n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Binding affinity at human GST-tagged PPARdelta ligand binding domain after 1 hr by time-resolved FRET analysis


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50126018
PNG
(2-(3-chloro-4-(3-(7-propyl-3-(trifluoromethyl)benz...)
Show SMILES CCCc1c(OCCCSc2ccc(CC(O)=O)cc2Cl)ccc2c(noc12)C(F)(F)F
Show InChI InChI=1S/C22H21ClF3NO4S/c1-2-4-14-17(7-6-15-20(14)31-27-21(15)22(24,25)26)30-9-3-10-32-18-8-5-13(11-16(18)23)12-19(28)29/h5-8,11H,2-4,9-10,12H2,1H3,(H,28,29)
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n/an/an/an/a 7.90n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Binding affinity at human GST-tagged PPARdelta ligand binding domain after 1 hr by time-resolved FRET analysis


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%