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PubMed code 19301897

Compile data set for download or QSAR
Found 63 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 alpha


(Homo sapiens (Human))		BDBM50257302
PNG
(2-(1-{3-[6-(Furan-3-carbonyl)-1-propyl-naphthalen-...)
Show SMILES CCCc1c(OCCCn2ccc3cc(OC(C)(C)C(O)=O)ccc23)ccc2cc(ccc12)C(=O)c1ccoc1
Show InChI InChI=1S/C33H33NO6/c1-4-6-28-27-10-7-24(31(35)25-14-18-38-21-25)19-22(27)8-12-30(28)39-17-5-15-34-16-13-23-20-26(9-11-29(23)34)40-33(2,3)32(36)37/h7-14,16,18-21H,4-6,15,17H2,1-3H3,(H,36,37)
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n/an/an/an/a 130n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))		BDBM50257307
PNG
(2-(1-{3-[4-(Biphenyl-4-carbonyl)-2-propyl-phenoxy]...)
Show SMILES CCCc1cc(ccc1OCCCn1ccc2cc(OC(C)(C)C(O)=O)ccc12)C(=O)c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C37H37NO5/c1-4-9-30-24-31(35(39)28-14-12-27(13-15-28)26-10-6-5-7-11-26)16-19-34(30)42-23-8-21-38-22-20-29-25-32(17-18-33(29)38)43-37(2,3)36(40)41/h5-7,10-20,22,24-25H,4,8-9,21,23H2,1-3H3,(H,40,41)
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n/an/an/an/a>1.00E+4n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARdelta receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))		BDBM50257301
PNG
(2-Methyl-2-(1-{3-[1-propyl-6-(pyridine-4-carbonyl)...)
Show SMILES CCCc1c(OCCCn2ccc3cc(OC(C)(C)C(O)=O)ccc23)ccc2cc(ccc12)C(=O)c1ccncc1
Show InChI InChI=1S/C34H34N2O5/c1-4-6-29-28-10-7-26(32(37)23-13-16-35-17-14-23)21-24(28)8-12-31(29)40-20-5-18-36-19-15-25-22-27(9-11-30(25)36)41-34(2,3)33(38)39/h7-17,19,21-22H,4-6,18,20H2,1-3H3,(H,38,39)
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n/an/an/an/a 2.07E+3n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))		BDBM50257302
PNG
(2-(1-{3-[6-(Furan-3-carbonyl)-1-propyl-naphthalen-...)
Show SMILES CCCc1c(OCCCn2ccc3cc(OC(C)(C)C(O)=O)ccc23)ccc2cc(ccc12)C(=O)c1ccoc1
Show InChI InChI=1S/C33H33NO6/c1-4-6-28-27-10-7-24(31(35)25-14-18-38-21-25)19-22(27)8-12-30(28)39-17-5-15-34-16-13-23-20-26(9-11-29(23)34)40-33(2,3)32(36)37/h7-14,16,18-21H,4-6,15,17H2,1-3H3,(H,36,37)
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n/an/an/an/a>1.00E+4n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARdelta receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))		BDBM50257364
PNG
(2-(1-{3-[4-(Biphenyl-4-carbonyl)-2-propyl-phenoxy]...)
Show SMILES CCCc1cc(ccc1OCCCN1CCCc2cc(OC(C)(C)C(O)=O)ccc12)C(=O)c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C38H41NO5/c1-4-10-31-25-32(36(40)29-16-14-28(15-17-29)27-11-6-5-7-12-27)18-21-35(31)43-24-9-23-39-22-8-13-30-26-33(19-20-34(30)39)44-38(2,3)37(41)42/h5-7,11-12,14-21,25-26H,4,8-10,13,22-24H2,1-3H3,(H,41,42)
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n/an/an/an/a>1.00E+4n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))		BDBM50196246
PNG
(2-(1-(3-(6-benzoyl-1-propylnaphthalen-2-yloxy)prop...)
Show SMILES CCCc1c(OCCCn2ccc3cc(OC(C)(C)C(O)=O)ccc23)ccc2cc(ccc12)C(=O)c1ccccc1
Show InChI InChI=1S/C35H35NO5/c1-4-9-30-29-15-12-27(33(37)24-10-6-5-7-11-24)22-25(29)13-17-32(30)40-21-8-19-36-20-18-26-23-28(14-16-31(26)36)41-35(2,3)34(38)39/h5-7,10-18,20,22-23H,4,8-9,19,21H2,1-3H3,(H,38,39)
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n/an/an/an/a 650n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))		BDBM50257254
PNG
(2-{1-[3-(5-Benzoyl-1-propyl-naphthalen-2-yloxy)-pr...)
Show SMILES CCCc1c(OCCCn2ccc3cc(OC(C)(C)C(O)=O)ccc23)ccc2c(cccc12)C(=O)c1ccccc1
Show InChI InChI=1S/C35H35NO5/c1-4-10-29-27-13-8-14-30(33(37)24-11-6-5-7-12-24)28(27)16-18-32(29)40-22-9-20-36-21-19-25-23-26(15-17-31(25)36)41-35(2,3)34(38)39/h5-8,11-19,21,23H,4,9-10,20,22H2,1-3H3,(H,38,39)
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n/an/an/an/a 3.50E+3n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))		BDBM50257302
PNG
(2-(1-{3-[6-(Furan-3-carbonyl)-1-propyl-naphthalen-...)
Show SMILES CCCc1c(OCCCn2ccc3cc(OC(C)(C)C(O)=O)ccc23)ccc2cc(ccc12)C(=O)c1ccoc1
Show InChI InChI=1S/C33H33NO6/c1-4-6-28-27-10-7-24(31(35)25-14-18-38-21-25)19-22(27)8-12-30(28)39-17-5-15-34-16-13-23-20-26(9-11-29(23)34)40-33(2,3)32(36)37/h7-14,16,18-21H,4-6,15,17H2,1-3H3,(H,36,37)
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n/an/an/an/a 430n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))		BDBM50257308
PNG
(2-(1-{3-[4-(Biphenyl-4-carbonyl)-2-propyl-phenoxy]...)
Show SMILES CCCc1cc(ccc1OCCCn1ccc2c(OC(C)(C)C(O)=O)cccc12)C(=O)c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C37H37NO5/c1-4-10-29-25-30(35(39)28-17-15-27(16-18-28)26-11-6-5-7-12-26)19-20-33(29)42-24-9-22-38-23-21-31-32(38)13-8-14-34(31)43-37(2,3)36(40)41/h5-8,11-21,23,25H,4,9-10,22,24H2,1-3H3,(H,40,41)
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n/an/an/an/a 300n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))		BDBM50257359
PNG
(2-(1-{3-[4-(4-Fluoro-benzoyl)-2-propyl-phenoxy]-pr...)
Show SMILES CCCc1cc(ccc1OCCCn1ccc2cc(OC(C)(C)C(O)=O)ccc12)C(=O)c1ccc(F)cc1
Show InChI InChI=1S/C31H32FNO5/c1-4-6-23-19-24(29(34)21-7-10-25(32)11-8-21)9-14-28(23)37-18-5-16-33-17-15-22-20-26(12-13-27(22)33)38-31(2,3)30(35)36/h7-15,17,19-20H,4-6,16,18H2,1-3H3,(H,35,36)
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n/an/an/an/a 900n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))		BDBM50257360
PNG
(2-(1-{3-[4-(4-Methoxy-benzoyl)-2-propyl-phenoxy]-p...)
Show SMILES CCCc1cc(ccc1OCCCn1ccc2cc(OC(C)(C)C(O)=O)ccc12)C(=O)c1ccc(OC)cc1
Show InChI InChI=1S/C32H35NO6/c1-5-7-24-20-25(30(34)22-8-11-26(37-4)12-9-22)10-15-29(24)38-19-6-17-33-18-16-23-21-27(13-14-28(23)33)39-32(2,3)31(35)36/h8-16,18,20-21H,5-7,17,19H2,1-4H3,(H,35,36)
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n/an/an/an/a 470n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))		BDBM50257358
PNG
(2-{1-[3-(4-Benzoyl-2-propyl-phenoxy)-propyl]-1H-in...)
Show SMILES CCCc1cc(ccc1OCCCn1ccc2c(OC(C)(C)C(O)=O)cccc12)C(=O)c1ccccc1
Show InChI InChI=1S/C31H33NO5/c1-4-10-23-21-24(29(33)22-11-6-5-7-12-22)15-16-27(23)36-20-9-18-32-19-17-25-26(32)13-8-14-28(25)37-31(2,3)30(34)35/h5-8,11-17,19,21H,4,9-10,18,20H2,1-3H3,(H,34,35)
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n/an/an/an/a>1.00E+4n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARdelta receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))		BDBM50257361
PNG
(2-{1-[3-(6-Benzoyl-1-propyl-naphthalen-2-yloxy)-pr...)
Show SMILES CCCc1c(OCCCN2CCCc3c(OC(C)(C)C(O)=O)cccc23)ccc2cc(ccc12)C(=O)c1ccccc1
Show InChI InChI=1S/C36H39NO5/c1-4-11-29-28-19-17-27(34(38)25-12-6-5-7-13-25)24-26(28)18-20-32(29)41-23-10-22-37-21-9-14-30-31(37)15-8-16-33(30)42-36(2,3)35(39)40/h5-8,12-13,15-20,24H,4,9-11,14,21-23H2,1-3H3,(H,39,40)
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n/an/an/an/a>1.00E+4n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARdelta receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))		BDBM50257362
PNG
(2-{1-[3-(6-Benzoyl-1-propyl-naphthalen-2-yloxy)-pr...)
Show SMILES CCCc1c(OCCCN2CCCc3cc(OC(C)(C)C(O)=O)ccc23)ccc2cc(ccc12)C(=O)c1ccccc1
Show InChI InChI=1S/C36H39NO5/c1-4-10-31-30-17-14-28(34(38)25-11-6-5-7-12-25)23-26(30)15-19-33(31)41-22-9-21-37-20-8-13-27-24-29(16-18-32(27)37)42-36(2,3)35(39)40/h5-7,11-12,14-19,23-24H,4,8-10,13,20-22H2,1-3H3,(H,39,40)
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n/an/an/an/a>1.00E+4n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARdelta receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))		BDBM50257254
PNG
(2-{1-[3-(5-Benzoyl-1-propyl-naphthalen-2-yloxy)-pr...)
Show SMILES CCCc1c(OCCCn2ccc3cc(OC(C)(C)C(O)=O)ccc23)ccc2c(cccc12)C(=O)c1ccccc1
Show InChI InChI=1S/C35H35NO5/c1-4-10-29-27-13-8-14-30(33(37)24-11-6-5-7-12-24)28(27)16-18-32(29)40-22-9-20-36-21-19-25-23-26(15-17-31(25)36)41-35(2,3)34(38)39/h5-8,11-19,21,23H,4,9-10,20,22H2,1-3H3,(H,38,39)
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n/an/an/an/a 200n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))		BDBM50257304
PNG
(2-(1-{3-[6-(4-Methoxy-benzoyl)-1-propyl-naphthalen...)
Show SMILES CCCc1c(OCCCn2ccc3cc(OC(C)(C)C(O)=O)ccc23)ccc2cc(ccc12)C(=O)c1ccc(OC)cc1
Show InChI InChI=1S/C36H37NO6/c1-5-7-31-30-15-10-27(34(38)24-8-12-28(41-4)13-9-24)22-25(30)11-17-33(31)42-21-6-19-37-20-18-26-23-29(14-16-32(26)37)43-36(2,3)35(39)40/h8-18,20,22-23H,5-7,19,21H2,1-4H3,(H,39,40)
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n/an/an/an/a 130n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))		BDBM50257306
PNG
(2-Methyl-2-(1-{3-[4-(naphthalene-2-carbonyl)-2-pro...)
Show SMILES CCCc1cc(ccc1OCCCn1ccc2c(OC(C)(C)C(O)=O)cccc12)C(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C35H35NO5/c1-4-9-26-23-28(33(37)27-15-14-24-10-5-6-11-25(24)22-27)16-17-31(26)40-21-8-19-36-20-18-29-30(36)12-7-13-32(29)41-35(2,3)34(38)39/h5-7,10-18,20,22-23H,4,8-9,19,21H2,1-3H3,(H,38,39)
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n/an/an/an/a 30n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))		BDBM50257308
PNG
(2-(1-{3-[4-(Biphenyl-4-carbonyl)-2-propyl-phenoxy]...)
Show SMILES CCCc1cc(ccc1OCCCn1ccc2c(OC(C)(C)C(O)=O)cccc12)C(=O)c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C37H37NO5/c1-4-10-29-25-30(35(39)28-17-15-27(16-18-28)26-11-6-5-7-12-26)19-20-33(29)42-24-9-22-38-23-21-31-32(38)13-8-14-34(31)43-37(2,3)36(40)41/h5-8,11-21,23,25H,4,9-10,22,24H2,1-3H3,(H,40,41)
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n/an/an/an/a 4.07E+3n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))		BDBM50257300
PNG
(2-{1-[3-(6-Acetyl-1-propyl-naphthalen-2-yloxy)-pro...)
Show SMILES CCCc1c(OCCCn2ccc3cc(OC(C)(C)C(O)=O)ccc23)ccc2cc(ccc12)C(C)=O
Show InChI InChI=1S/C30H33NO5/c1-5-7-26-25-11-8-21(20(2)32)18-22(25)9-13-28(26)35-17-6-15-31-16-14-23-19-24(10-12-27(23)31)36-30(3,4)29(33)34/h8-14,16,18-19H,5-7,15,17H2,1-4H3,(H,33,34)
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n/an/an/an/a 1.07E+3n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))		BDBM50257303
PNG
(2-(1-{3-[6-(4-Fluoro-benzoyl)-1-propyl-naphthalen-...)
Show SMILES CCCc1c(OCCCn2ccc3cc(OC(C)(C)C(O)=O)ccc23)ccc2cc(ccc12)C(=O)c1ccc(F)cc1
Show InChI InChI=1S/C35H34FNO5/c1-4-6-30-29-14-9-26(33(38)23-7-11-27(36)12-8-23)21-24(29)10-16-32(30)41-20-5-18-37-19-17-25-22-28(13-15-31(25)37)42-35(2,3)34(39)40/h7-17,19,21-22H,4-6,18,20H2,1-3H3,(H,39,40)
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n/an/an/an/a 2.12E+3n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))		BDBM50257362
PNG
(2-{1-[3-(6-Benzoyl-1-propyl-naphthalen-2-yloxy)-pr...)
Show SMILES CCCc1c(OCCCN2CCCc3cc(OC(C)(C)C(O)=O)ccc23)ccc2cc(ccc12)C(=O)c1ccccc1
Show InChI InChI=1S/C36H39NO5/c1-4-10-31-30-17-14-28(34(38)25-11-6-5-7-12-25)23-26(30)15-19-33(31)41-22-9-21-37-20-8-13-27-24-29(16-18-32(27)37)42-36(2,3)35(39)40/h5-7,11-12,14-19,23-24H,4,8-10,13,20-22H2,1-3H3,(H,39,40)
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n/an/an/an/a 540n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(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 220n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))		BDBM50196246
PNG
(2-(1-(3-(6-benzoyl-1-propylnaphthalen-2-yloxy)prop...)
Show SMILES CCCc1c(OCCCn2ccc3cc(OC(C)(C)C(O)=O)ccc23)ccc2cc(ccc12)C(=O)c1ccccc1
Show InChI InChI=1S/C35H35NO5/c1-4-9-30-29-15-12-27(33(37)24-10-6-5-7-11-24)22-25(29)13-17-32(30)40-21-8-19-36-20-18-26-23-28(14-16-31(26)36)41-35(2,3)34(38)39/h5-7,10-18,20,22-23H,4,8-9,19,21H2,1-3H3,(H,38,39)
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n/an/an/an/a>1.00E+4n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARdelta receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))		BDBM50257255
PNG
(2-{1-[3-(6-Benzyl-1-propyl-naphthalen-2-yloxy)-pro...)
Show SMILES CCCc1c(OCCCn2ccc3cc(OC(C)(C)C(O)=O)ccc23)ccc2cc(Cc3ccccc3)ccc12
Show InChI InChI=1S/C35H37NO4/c1-4-9-31-30-15-12-26(22-25-10-6-5-7-11-25)23-27(30)13-17-33(31)39-21-8-19-36-20-18-28-24-29(14-16-32(28)36)40-35(2,3)34(37)38/h5-7,10-18,20,23-24H,4,8-9,19,21-22H2,1-3H3,(H,37,38)
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n/an/an/an/a>1.00E+4n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))		BDBM50257301
PNG
(2-Methyl-2-(1-{3-[1-propyl-6-(pyridine-4-carbonyl)...)
Show SMILES CCCc1c(OCCCn2ccc3cc(OC(C)(C)C(O)=O)ccc23)ccc2cc(ccc12)C(=O)c1ccncc1
Show InChI InChI=1S/C34H34N2O5/c1-4-6-29-28-10-7-26(32(37)23-13-16-35-17-14-23)21-24(28)8-12-31(29)40-20-5-18-36-19-15-25-22-27(9-11-30(25)36)41-34(2,3)33(38)39/h7-17,19,21-22H,4-6,18,20H2,1-3H3,(H,38,39)
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n/an/an/an/a>1.00E+4n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))		BDBM50257305
PNG
(2-Methyl-2-(1-{3-[4-(naphthalene-2-carbonyl)-2-pro...)
Show SMILES CCCc1cc(ccc1OCCCn1ccc2cc(OC(C)(C)C(O)=O)ccc12)C(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C35H35NO5/c1-4-8-27-22-29(33(37)28-12-11-24-9-5-6-10-25(24)21-28)13-16-32(27)40-20-7-18-36-19-17-26-23-30(14-15-31(26)36)41-35(2,3)34(38)39/h5-6,9-17,19,21-23H,4,7-8,18,20H2,1-3H3,(H,38,39)
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n/an/an/an/a 30n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))		BDBM50257360
PNG
(2-(1-{3-[4-(4-Methoxy-benzoyl)-2-propyl-phenoxy]-p...)
Show SMILES CCCc1cc(ccc1OCCCn1ccc2cc(OC(C)(C)C(O)=O)ccc12)C(=O)c1ccc(OC)cc1
Show InChI InChI=1S/C32H35NO6/c1-5-7-24-20-25(30(34)22-8-11-26(37-4)12-9-22)10-15-29(24)38-19-6-17-33-18-16-23-21-27(13-14-28(23)33)39-32(2,3)31(35)36/h8-16,18,20-21H,5-7,17,19H2,1-4H3,(H,35,36)
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n/an/an/an/a 50n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))		BDBM50257363
PNG
(2-(1-{3-[4-(Biphenyl-4-carbonyl)-2-propylphenoxy]p...)
Show SMILES CCCc1cc(ccc1OCCCN1CCCc2c(OC(C)(C)C(O)=O)cccc12)C(=O)c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C38H41NO5/c1-4-11-30-26-31(36(40)29-19-17-28(18-20-29)27-12-6-5-7-13-27)21-22-34(30)43-25-10-24-39-23-9-14-32-33(39)15-8-16-35(32)44-38(2,3)37(41)42/h5-8,12-13,15-22,26H,4,9-11,14,23-25H2,1-3H3,(H,41,42)
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n/an/an/an/a 3.99E+3n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))		BDBM50257361
PNG
(2-{1-[3-(6-Benzoyl-1-propyl-naphthalen-2-yloxy)-pr...)
Show SMILES CCCc1c(OCCCN2CCCc3c(OC(C)(C)C(O)=O)cccc23)ccc2cc(ccc12)C(=O)c1ccccc1
Show InChI InChI=1S/C36H39NO5/c1-4-11-29-28-19-17-27(34(38)25-12-6-5-7-13-25)24-26(28)18-20-32(29)41-23-10-22-37-21-9-14-30-31(37)15-8-16-33(30)42-36(2,3)35(39)40/h5-8,12-13,15-20,24H,4,9-11,14,21-23H2,1-3H3,(H,39,40)
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n/an/an/an/a 100n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))		BDBM50257304
PNG
(2-(1-{3-[6-(4-Methoxy-benzoyl)-1-propyl-naphthalen...)
Show SMILES CCCc1c(OCCCn2ccc3cc(OC(C)(C)C(O)=O)ccc23)ccc2cc(ccc12)C(=O)c1ccc(OC)cc1
Show InChI InChI=1S/C36H37NO6/c1-5-7-31-30-15-10-27(34(38)24-8-12-28(41-4)13-9-24)22-25(30)11-17-33(31)42-21-6-19-37-20-18-26-23-29(14-16-32(26)37)43-36(2,3)35(39)40/h8-18,20,22-23H,5-7,19,21H2,1-4H3,(H,39,40)
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n/an/an/an/a>1.00E+4n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARdelta receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))		BDBM50257359
PNG
(2-(1-{3-[4-(4-Fluoro-benzoyl)-2-propyl-phenoxy]-pr...)
Show SMILES CCCc1cc(ccc1OCCCn1ccc2cc(OC(C)(C)C(O)=O)ccc12)C(=O)c1ccc(F)cc1
Show InChI InChI=1S/C31H32FNO5/c1-4-6-23-19-24(29(34)21-7-10-25(32)11-8-21)9-14-28(23)37-18-5-16-33-17-15-22-20-26(12-13-27(22)33)38-31(2,3)30(35)36/h7-15,17,19-20H,4-6,16,18H2,1-3H3,(H,35,36)
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n/an/an/an/a>1.00E+4n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARdelta receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))		BDBM50257364
PNG
(2-(1-{3-[4-(Biphenyl-4-carbonyl)-2-propyl-phenoxy]...)
Show SMILES CCCc1cc(ccc1OCCCN1CCCc2cc(OC(C)(C)C(O)=O)ccc12)C(=O)c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C38H41NO5/c1-4-10-31-25-32(36(40)29-16-14-28(15-17-29)27-11-6-5-7-12-27)18-21-35(31)43-24-9-23-39-22-8-13-30-26-33(19-20-34(30)39)44-38(2,3)37(41)42/h5-7,11-12,14-21,25-26H,4,8-10,13,22-24H2,1-3H3,(H,41,42)
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n/an/an/an/a>1.00E+4n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARdelta receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))		BDBM50257362
PNG
(2-{1-[3-(6-Benzoyl-1-propyl-naphthalen-2-yloxy)-pr...)
Show SMILES CCCc1c(OCCCN2CCCc3cc(OC(C)(C)C(O)=O)ccc23)ccc2cc(ccc12)C(=O)c1ccccc1
Show InChI InChI=1S/C36H39NO5/c1-4-10-31-30-17-14-28(34(38)25-11-6-5-7-12-25)23-26(30)15-19-33(31)41-22-9-21-37-20-8-13-27-24-29(16-18-32(27)37)42-36(2,3)35(39)40/h5-7,11-12,14-19,23-24H,4,8-10,13,20-22H2,1-3H3,(H,39,40)
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n/an/an/an/a 240n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))		BDBM50257255
PNG
(2-{1-[3-(6-Benzyl-1-propyl-naphthalen-2-yloxy)-pro...)
Show SMILES CCCc1c(OCCCn2ccc3cc(OC(C)(C)C(O)=O)ccc23)ccc2cc(Cc3ccccc3)ccc12
Show InChI InChI=1S/C35H37NO4/c1-4-9-31-30-15-12-26(22-25-10-6-5-7-11-25)23-27(30)13-17-33(31)39-21-8-19-36-20-18-28-24-29(14-16-32(28)36)40-35(2,3)34(37)38/h5-7,10-18,20,23-24H,4,8-9,19,21-22H2,1-3H3,(H,37,38)
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n/an/an/an/a>1.00E+4n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))		BDBM50257304
PNG
(2-(1-{3-[6-(4-Methoxy-benzoyl)-1-propyl-naphthalen...)
Show SMILES CCCc1c(OCCCn2ccc3cc(OC(C)(C)C(O)=O)ccc23)ccc2cc(ccc12)C(=O)c1ccc(OC)cc1
Show InChI InChI=1S/C36H37NO6/c1-5-7-31-30-15-10-27(34(38)24-8-12-28(41-4)13-9-24)22-25(30)11-17-33(31)42-21-6-19-37-20-18-26-23-29(14-16-32(26)37)43-36(2,3)35(39)40/h8-18,20,22-23H,5-7,19,21H2,1-4H3,(H,39,40)
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n/an/an/an/a 510n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))		BDBM50257309
PNG
(2-{1-[3-(4-Benzoyl-2-propyl-phenoxy)-propyl]-1H-in...)
Show SMILES CCCc1cc(ccc1OCCCn1ccc2cc(OC(C)(C)C(O)=O)ccc12)C(=O)c1ccccc1
Show InChI InChI=1S/C31H33NO5/c1-4-9-24-20-25(29(33)22-10-6-5-7-11-22)12-15-28(24)36-19-8-17-32-18-16-23-21-26(13-14-27(23)32)37-31(2,3)30(34)35/h5-7,10-16,18,20-21H,4,8-9,17,19H2,1-3H3,(H,34,35)
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n/an/an/an/a 420n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))		BDBM50257303
PNG
(2-(1-{3-[6-(4-Fluoro-benzoyl)-1-propyl-naphthalen-...)
Show SMILES CCCc1c(OCCCn2ccc3cc(OC(C)(C)C(O)=O)ccc23)ccc2cc(ccc12)C(=O)c1ccc(F)cc1
Show InChI InChI=1S/C35H34FNO5/c1-4-6-30-29-14-9-26(33(38)23-7-11-27(36)12-8-23)21-24(29)10-16-32(30)41-20-5-18-37-19-17-25-22-28(13-15-31(25)37)42-35(2,3)34(39)40/h7-17,19,21-22H,4-6,18,20H2,1-3H3,(H,39,40)
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n/an/an/an/a>1.00E+4n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARdelta receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))		BDBM50257305
PNG
(2-Methyl-2-(1-{3-[4-(naphthalene-2-carbonyl)-2-pro...)
Show SMILES CCCc1cc(ccc1OCCCn1ccc2cc(OC(C)(C)C(O)=O)ccc12)C(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C35H35NO5/c1-4-8-27-22-29(33(37)28-12-11-24-9-5-6-10-25(24)21-28)13-16-32(27)40-20-7-18-36-19-17-26-23-30(14-15-31(26)36)41-35(2,3)34(38)39/h5-6,9-17,19,21-23H,4,7-8,18,20H2,1-3H3,(H,38,39)
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n/an/an/an/a>1.00E+4n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARdelta receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))		BDBM50257309
PNG
(2-{1-[3-(4-Benzoyl-2-propyl-phenoxy)-propyl]-1H-in...)
Show SMILES CCCc1cc(ccc1OCCCn1ccc2cc(OC(C)(C)C(O)=O)ccc12)C(=O)c1ccccc1
Show InChI InChI=1S/C31H33NO5/c1-4-9-24-20-25(29(33)22-10-6-5-7-11-22)12-15-28(24)36-19-8-17-32-18-16-23-21-26(13-14-27(23)32)37-31(2,3)30(34)35/h5-7,10-16,18,20-21H,4,8-9,17,19H2,1-3H3,(H,34,35)
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n/an/an/an/a 5.27E+3n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARdelta receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))		BDBM50257360
PNG
(2-(1-{3-[4-(4-Methoxy-benzoyl)-2-propyl-phenoxy]-p...)
Show SMILES CCCc1cc(ccc1OCCCn1ccc2cc(OC(C)(C)C(O)=O)ccc12)C(=O)c1ccc(OC)cc1
Show InChI InChI=1S/C32H35NO6/c1-5-7-24-20-25(30(34)22-8-11-26(37-4)12-9-22)10-15-29(24)38-19-6-17-33-18-16-23-21-27(13-14-28(23)33)39-32(2,3)31(35)36/h8-16,18,20-21H,5-7,17,19H2,1-4H3,(H,35,36)
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n/an/an/an/a 4.45E+3n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARdelta receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(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>1.00E+4n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARdelta receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))		BDBM50257300
PNG
(2-{1-[3-(6-Acetyl-1-propyl-naphthalen-2-yloxy)-pro...)
Show SMILES CCCc1c(OCCCn2ccc3cc(OC(C)(C)C(O)=O)ccc23)ccc2cc(ccc12)C(C)=O
Show InChI InChI=1S/C30H33NO5/c1-5-7-26-25-11-8-21(20(2)32)18-22(25)9-13-28(26)35-17-6-15-31-16-14-23-19-24(10-12-27(23)31)36-30(3,4)29(33)34/h8-14,16,18-19H,5-7,15,17H2,1-4H3,(H,33,34)
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n/an/an/an/a>1.00E+4n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))		BDBM50257358
PNG
(2-{1-[3-(4-Benzoyl-2-propyl-phenoxy)-propyl]-1H-in...)
Show SMILES CCCc1cc(ccc1OCCCn1ccc2c(OC(C)(C)C(O)=O)cccc12)C(=O)c1ccccc1
Show InChI InChI=1S/C31H33NO5/c1-4-10-23-21-24(29(33)22-11-6-5-7-12-22)15-16-27(23)36-20-9-18-32-19-17-25-26(32)13-8-14-28(25)37-31(2,3)30(34)35/h5-8,11-17,19,21H,4,9-10,18,20H2,1-3H3,(H,34,35)
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n/an/an/an/a 30n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))		BDBM50257363
PNG
(2-(1-{3-[4-(Biphenyl-4-carbonyl)-2-propylphenoxy]p...)
Show SMILES CCCc1cc(ccc1OCCCN1CCCc2c(OC(C)(C)C(O)=O)cccc12)C(=O)c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C38H41NO5/c1-4-11-30-26-31(36(40)29-19-17-28(18-20-29)27-12-6-5-7-13-27)21-22-34(30)43-25-10-24-39-23-9-14-32-33(39)15-8-16-35(32)44-38(2,3)37(41)42/h5-8,12-13,15-22,26H,4,9-11,14,23-25H2,1-3H3,(H,41,42)
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n/an/an/an/a 50n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))		BDBM50257254
PNG
(2-{1-[3-(5-Benzoyl-1-propyl-naphthalen-2-yloxy)-pr...)
Show SMILES CCCc1c(OCCCn2ccc3cc(OC(C)(C)C(O)=O)ccc23)ccc2c(cccc12)C(=O)c1ccccc1
Show InChI InChI=1S/C35H35NO5/c1-4-10-29-27-13-8-14-30(33(37)24-11-6-5-7-12-24)28(27)16-18-32(29)40-22-9-20-36-21-19-25-23-26(15-17-31(25)36)41-35(2,3)34(38)39/h5-8,11-19,21,23H,4,9-10,20,22H2,1-3H3,(H,38,39)
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n/an/an/an/a>1.00E+4n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARdelta receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))		BDBM50257255
PNG
(2-{1-[3-(6-Benzyl-1-propyl-naphthalen-2-yloxy)-pro...)
Show SMILES CCCc1c(OCCCn2ccc3cc(OC(C)(C)C(O)=O)ccc23)ccc2cc(Cc3ccccc3)ccc12
Show InChI InChI=1S/C35H37NO4/c1-4-9-31-30-15-12-26(22-25-10-6-5-7-11-25)23-27(30)13-17-33(31)39-21-8-19-36-20-18-28-24-29(14-16-32(28)36)40-35(2,3)34(37)38/h5-7,10-18,20,23-24H,4,8-9,19,21-22H2,1-3H3,(H,37,38)
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n/an/an/an/a>1.00E+4n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARdelta receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))		BDBM50257300
PNG
(2-{1-[3-(6-Acetyl-1-propyl-naphthalen-2-yloxy)-pro...)
Show SMILES CCCc1c(OCCCn2ccc3cc(OC(C)(C)C(O)=O)ccc23)ccc2cc(ccc12)C(C)=O
Show InChI InChI=1S/C30H33NO5/c1-5-7-26-25-11-8-21(20(2)32)18-22(25)9-13-28(26)35-17-6-15-31-16-14-23-19-24(10-12-27(23)31)36-30(3,4)29(33)34/h8-14,16,18-19H,5-7,15,17H2,1-4H3,(H,33,34)
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n/an/an/an/a>1.00E+4n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARdelta receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))		BDBM50257306
PNG
(2-Methyl-2-(1-{3-[4-(naphthalene-2-carbonyl)-2-pro...)
Show SMILES CCCc1cc(ccc1OCCCn1ccc2c(OC(C)(C)C(O)=O)cccc12)C(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C35H35NO5/c1-4-9-26-23-28(33(37)27-15-14-24-10-5-6-11-25(24)22-27)16-17-31(26)40-21-8-19-36-20-18-29-30(36)12-7-13-32(29)41-35(2,3)34(38)39/h5-7,10-18,20,22-23H,4,8-9,19,21H2,1-3H3,(H,38,39)
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n/an/an/an/a>1.00E+4n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARdelta receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))		BDBM50257308
PNG
(2-(1-{3-[4-(Biphenyl-4-carbonyl)-2-propyl-phenoxy]...)
Show SMILES CCCc1cc(ccc1OCCCn1ccc2c(OC(C)(C)C(O)=O)cccc12)C(=O)c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C37H37NO5/c1-4-10-29-25-30(35(39)28-17-15-27(16-18-28)26-11-6-5-7-12-26)19-20-33(29)42-24-9-22-38-23-21-31-32(38)13-8-14-34(31)43-37(2,3)36(40)41/h5-8,11-21,23,25H,4,9-10,22,24H2,1-3H3,(H,40,41)
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n/an/an/an/a>1.00E+4n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARdelta receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))		BDBM50257303
PNG
(2-(1-{3-[6-(4-Fluoro-benzoyl)-1-propyl-naphthalen-...)
Show SMILES CCCc1c(OCCCn2ccc3cc(OC(C)(C)C(O)=O)ccc23)ccc2cc(ccc12)C(=O)c1ccc(F)cc1
Show InChI InChI=1S/C35H34FNO5/c1-4-6-30-29-14-9-26(33(38)23-7-11-27(36)12-8-23)21-24(29)10-16-32(30)41-20-5-18-37-19-17-25-22-28(13-15-31(25)37)42-35(2,3)34(39)40/h7-17,19,21-22H,4-6,18,20H2,1-3H3,(H,39,40)
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n/an/an/an/a>1.00E+4n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))		BDBM50257309
PNG
(2-{1-[3-(4-Benzoyl-2-propyl-phenoxy)-propyl]-1H-in...)
Show SMILES CCCc1cc(ccc1OCCCn1ccc2cc(OC(C)(C)C(O)=O)ccc12)C(=O)c1ccccc1
Show InChI InChI=1S/C31H33NO5/c1-4-9-24-20-25(29(33)22-10-6-5-7-11-22)12-15-28(24)36-19-8-17-32-18-16-23-21-26(13-14-27(23)32)37-31(2,3)30(34)35/h5-7,10-16,18,20-21H,4,8-9,17,19H2,1-3H3,(H,34,35)
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n/an/an/an/a 40n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))		BDBM50257305
PNG
(2-Methyl-2-(1-{3-[4-(naphthalene-2-carbonyl)-2-pro...)
Show SMILES CCCc1cc(ccc1OCCCn1ccc2cc(OC(C)(C)C(O)=O)ccc12)C(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C35H35NO5/c1-4-8-27-22-29(33(37)28-12-11-24-9-5-6-10-25(24)21-28)13-16-32(27)40-20-7-18-36-19-17-26-23-30(14-15-31(26)36)41-35(2,3)34(38)39/h5-6,9-17,19,21-23H,4,7-8,18,20H2,1-3H3,(H,38,39)
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n/an/an/an/a 370n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))		BDBM50257306
PNG
(2-Methyl-2-(1-{3-[4-(naphthalene-2-carbonyl)-2-pro...)
Show SMILES CCCc1cc(ccc1OCCCn1ccc2c(OC(C)(C)C(O)=O)cccc12)C(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C35H35NO5/c1-4-9-26-23-28(33(37)27-15-14-24-10-5-6-11-25(24)22-27)16-17-31(26)40-21-8-19-36-20-18-29-30(36)12-7-13-32(29)41-35(2,3)34(38)39/h5-7,10-18,20,22-23H,4,8-9,19,21H2,1-3H3,(H,38,39)
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n/an/an/an/a 2.80E+3n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))		BDBM50257364
PNG
(2-(1-{3-[4-(Biphenyl-4-carbonyl)-2-propyl-phenoxy]...)
Show SMILES CCCc1cc(ccc1OCCCN1CCCc2cc(OC(C)(C)C(O)=O)ccc12)C(=O)c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C38H41NO5/c1-4-10-31-25-32(36(40)29-16-14-28(15-17-29)27-11-6-5-7-12-27)18-21-35(31)43-24-9-23-39-22-8-13-30-26-33(19-20-34(30)39)44-38(2,3)37(41)42/h5-7,11-12,14-21,25-26H,4,8-10,13,22-24H2,1-3H3,(H,41,42)
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n/an/an/an/a 100n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))		BDBM50257363
PNG
(2-(1-{3-[4-(Biphenyl-4-carbonyl)-2-propylphenoxy]p...)
Show SMILES CCCc1cc(ccc1OCCCN1CCCc2c(OC(C)(C)C(O)=O)cccc12)C(=O)c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C38H41NO5/c1-4-11-30-26-31(36(40)29-19-17-28(18-20-29)27-12-6-5-7-13-27)21-22-34(30)43-25-10-24-39-23-9-14-32-33(39)15-8-16-35(32)44-38(2,3)37(41)42/h5-8,12-13,15-22,26H,4,9-11,14,23-25H2,1-3H3,(H,41,42)
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n/an/an/an/a>1.00E+4n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARdelta receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))		BDBM50196246
PNG
(2-(1-(3-(6-benzoyl-1-propylnaphthalen-2-yloxy)prop...)
Show SMILES CCCc1c(OCCCn2ccc3cc(OC(C)(C)C(O)=O)ccc23)ccc2cc(ccc12)C(=O)c1ccccc1
Show InChI InChI=1S/C35H35NO5/c1-4-9-30-29-15-12-27(33(37)24-10-6-5-7-11-24)22-25(29)13-17-32(30)40-21-8-19-36-20-18-26-23-28(14-16-31(26)36)41-35(2,3)34(38)39/h5-7,10-18,20,22-23H,4,8-9,19,21H2,1-3H3,(H,38,39)
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n/an/an/an/a 120n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))		BDBM50257307
PNG
(2-(1-{3-[4-(Biphenyl-4-carbonyl)-2-propyl-phenoxy]...)
Show SMILES CCCc1cc(ccc1OCCCn1ccc2cc(OC(C)(C)C(O)=O)ccc12)C(=O)c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C37H37NO5/c1-4-9-30-24-31(35(39)28-14-12-27(13-15-28)26-10-6-5-7-11-26)16-19-34(30)42-23-8-21-38-22-20-29-25-32(17-18-33(29)38)43-37(2,3)36(40)41/h5-7,10-20,22,24-25H,4,8-9,21,23H2,1-3H3,(H,40,41)
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n/an/an/an/a 1.92E+3n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))		BDBM50257359
PNG
(2-(1-{3-[4-(4-Fluoro-benzoyl)-2-propyl-phenoxy]-pr...)
Show SMILES CCCc1cc(ccc1OCCCn1ccc2cc(OC(C)(C)C(O)=O)ccc12)C(=O)c1ccc(F)cc1
Show InChI InChI=1S/C31H32FNO5/c1-4-6-23-19-24(29(34)21-7-10-25(32)11-8-21)9-14-28(23)37-18-5-16-33-17-15-22-20-26(12-13-27(22)33)38-31(2,3)30(35)36/h7-15,17,19-20H,4-6,16,18H2,1-3H3,(H,35,36)
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n/an/an/an/a 130n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))		BDBM50257361
PNG
(2-{1-[3-(6-Benzoyl-1-propyl-naphthalen-2-yloxy)-pr...)
Show SMILES CCCc1c(OCCCN2CCCc3c(OC(C)(C)C(O)=O)cccc23)ccc2cc(ccc12)C(=O)c1ccccc1
Show InChI InChI=1S/C36H39NO5/c1-4-11-29-28-19-17-27(34(38)25-12-6-5-7-13-25)24-26(28)18-20-32(29)41-23-10-22-37-21-9-14-30-31(37)15-8-16-33(30)42-36(2,3)35(39)40/h5-8,12-13,15-20,24H,4,9-11,14,21-23H2,1-3H3,(H,39,40)
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n/an/an/an/a 120n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))		BDBM50257307
PNG
(2-(1-{3-[4-(Biphenyl-4-carbonyl)-2-propyl-phenoxy]...)
Show SMILES CCCc1cc(ccc1OCCCn1ccc2cc(OC(C)(C)C(O)=O)ccc12)C(=O)c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C37H37NO5/c1-4-9-30-24-31(35(39)28-14-12-27(13-15-28)26-10-6-5-7-11-26)16-19-34(30)42-23-8-21-38-22-20-29-25-32(17-18-33(29)38)43-37(2,3)36(40)41/h5-7,10-20,22,24-25H,4,8-9,21,23H2,1-3H3,(H,40,41)
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n/an/an/an/a 120n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))		BDBM50257358
PNG
(2-{1-[3-(4-Benzoyl-2-propyl-phenoxy)-propyl]-1H-in...)
Show SMILES CCCc1cc(ccc1OCCCn1ccc2c(OC(C)(C)C(O)=O)cccc12)C(=O)c1ccccc1
Show InChI InChI=1S/C31H33NO5/c1-4-10-23-21-24(29(33)22-11-6-5-7-12-22)15-16-27(23)36-20-9-18-32-19-17-25-26(32)13-8-14-28(25)37-31(2,3)30(34)35/h5-8,11-17,19,21H,4,9-10,18,20H2,1-3H3,(H,34,35)
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n/an/an/an/a>1.00E+4n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))		BDBM50257301
PNG
(2-Methyl-2-(1-{3-[1-propyl-6-(pyridine-4-carbonyl)...)
Show SMILES CCCc1c(OCCCn2ccc3cc(OC(C)(C)C(O)=O)ccc23)ccc2cc(ccc12)C(=O)c1ccncc1
Show InChI InChI=1S/C34H34N2O5/c1-4-6-29-28-10-7-26(32(37)23-13-16-35-17-14-23)21-24(28)8-12-31(29)40-20-5-18-36-19-15-25-22-27(9-11-30(25)36)41-34(2,3)33(38)39/h7-17,19,21-22H,4-6,18,20H2,1-3H3,(H,38,39)
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n/an/an/an/a>1.00E+4n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARdelta receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(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>1.00E+4n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha receptor by cell based transactivation assay

J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%