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Compile Data Set for Download or QSAR

Found 48 hits with Last Name = 'osborne' and Initial = 'mc'   
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
Adenosine receptor A2a


(Homo sapiens (Human))
BDBM50330987
PNG
(2-amino-4-phenyl-8-(pyrrolidin-1-ylmethyl)-5H-inde...)
Show SMILES Nc1nc2-c3cc(CN4CCCC4)ccc3C(=O)c2c(n1)-c1ccccc1
Show InChI InChI=1S/C22H20N4O/c23-22-24-19(15-6-2-1-3-7-15)18-20(25-22)17-12-14(8-9-16(17)21(18)27)13-26-10-4-5-11-26/h1-3,6-9,12H,4-5,10-11,13H2,(H2,23,24,25)
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4.10n/an/an/an/an/an/an/an/a



Johnson& Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at adenosine A2A receptor


J Med Chem 53: 8104-15 (2010)

Checked by Author
Article DOI: 10.1021/jm100971t
BindingDB Entry DOI: 10.7270/Q2VT1SCG
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))
BDBM50330987
PNG
(2-amino-4-phenyl-8-(pyrrolidin-1-ylmethyl)-5H-inde...)
Show SMILES Nc1nc2-c3cc(CN4CCCC4)ccc3C(=O)c2c(n1)-c1ccccc1
Show InChI InChI=1S/C22H20N4O/c23-22-24-19(15-6-2-1-3-7-15)18-20(25-22)17-12-14(8-9-16(17)21(18)27)13-26-10-4-5-11-26/h1-3,6-9,12H,4-5,10-11,13H2,(H2,23,24,25)
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17n/an/an/an/an/an/an/an/a



Johnson& Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at adenosine A1 receptor


J Med Chem 53: 8104-15 (2010)

Checked by Author
Article DOI: 10.1021/jm100971t
BindingDB Entry DOI: 10.7270/Q2VT1SCG
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138058
PNG
(CHEMBL427478 | {2-[2-(4-Ethyl-3-oxo-3,4-dihydro-2H...)
Show SMILES CCN1C(=O)C(CCOc2ccccc2CC(O)=O)Oc2ccccc12
Show InChI InChI=1S/C20H21NO5/c1-2-21-15-8-4-6-10-17(15)26-18(20(21)24)11-12-25-16-9-5-3-7-14(16)13-19(22)23/h3-10,18H,2,11-13H2,1H3,(H,22,23)
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n/an/an/an/a>5.00E+3n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138062
PNG
((2-{2-[(S)-4-(6-Fluoro-hexyl)-3-oxo-3,4-dihydro-2H...)
Show SMILES OC(=O)Cc1ccccc1OCC[C@@H]1Oc2ccccc2N(CCCCCCF)C1=O
Show InChI InChI=1S/C24H28FNO5/c25-14-7-1-2-8-15-26-19-10-4-6-12-21(19)31-22(24(26)29)13-16-30-20-11-5-3-9-18(20)17-23(27)28/h3-6,9-12,22H,1-2,7-8,13-17H2,(H,27,28)/t22-/m0/s1
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n/an/an/an/a 570n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138063
PNG
((2-{2-[4-(7-Fluoro-heptyl)-3-oxo-3,4-dihydro-2H-be...)
Show SMILES OC(=O)Cc1ccccc1OCCC1Oc2ccccc2N(CCCCCCCF)C1=O
Show InChI InChI=1S/C25H30FNO5/c26-15-8-2-1-3-9-16-27-20-11-5-7-13-22(20)32-23(25(27)30)14-17-31-21-12-6-4-10-19(21)18-24(28)29/h4-7,10-13,23H,1-3,8-9,14-18H2,(H,28,29)
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n/an/an/an/a 718n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138061
PNG
((2-{2-[4-(3-Cyclopentyl-propyl)-3-oxo-3,4-dihydro-...)
Show SMILES OC(=O)Cc1ccccc1OCCC1Oc2ccccc2N(CCCC2CCCC2)C1=O
Show InChI InChI=1S/C26H31NO5/c28-25(29)18-20-11-3-5-13-22(20)31-17-15-24-26(30)27(16-7-10-19-8-1-2-9-19)21-12-4-6-14-23(21)32-24/h3-6,11-14,19,24H,1-2,7-10,15-18H2,(H,28,29)
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n/an/an/an/a 2.70E+3n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138060
PNG
(5-{2-[2-(2-Carboxymethyl-phenoxy)-ethyl]-3-oxo-2,3...)
Show SMILES OC(=O)CCCCN1C(=O)C(CCOc2ccccc2CC(O)=O)Oc2ccccc12
Show InChI InChI=1S/C23H25NO7/c25-21(26)11-5-6-13-24-17-8-2-4-10-19(17)31-20(23(24)29)12-14-30-18-9-3-1-7-16(18)15-22(27)28/h1-4,7-10,20H,5-6,11-15H2,(H,25,26)(H,27,28)
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n/an/an/an/a>5.00E+3n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138065
PNG
((2-{2-[4-(2-Hydroxy-ethyl)-3-oxo-3,4-dihydro-2H-be...)
Show SMILES OCCN1C(=O)C(CCOc2ccccc2CC(O)=O)Oc2ccccc12
Show InChI InChI=1S/C20H21NO6/c22-11-10-21-15-6-2-4-8-17(15)27-18(20(21)25)9-12-26-16-7-3-1-5-14(16)13-19(23)24/h1-8,18,22H,9-13H2,(H,23,24)
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n/an/an/an/a>5.00E+3n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138064
PNG
(CHEMBL178536 | {2-[2-(4-Octyl-3-oxo-3,4-dihydro-2H...)
Show SMILES CCCCCCCCN1C(=O)C(CCOc2ccccc2CC(O)=O)Oc2ccccc12
Show InChI InChI=1S/C26H33NO5/c1-2-3-4-5-6-11-17-27-21-13-8-10-15-23(21)32-24(26(27)30)16-18-31-22-14-9-7-12-20(22)19-25(28)29/h7-10,12-15,24H,2-6,11,16-19H2,1H3,(H,28,29)
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n/an/an/an/a 300n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138066
PNG
((2-{2-[4-(5,5-Difluoro-hexyl)-3-oxo-3,4-dihydro-2H...)
Show SMILES CC(F)(F)CCCCN1C(=O)C(CCOc2ccccc2CC(O)=O)Oc2ccccc12
Show InChI InChI=1S/C24H27F2NO5/c1-24(25,26)13-6-7-14-27-18-9-3-5-11-20(18)32-21(23(27)30)12-15-31-19-10-4-2-8-17(19)16-22(28)29/h2-5,8-11,21H,6-7,12-16H2,1H3,(H,28,29)
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n/an/an/an/a 179n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138067
PNG
((2-{2-[4-(4-Methoxy-butyl)-3-oxo-3,4-dihydro-2H-be...)
Show SMILES COCCCCN1C(=O)C(CCOc2ccccc2CC(O)=O)Oc2ccccc12
Show InChI InChI=1S/C23H27NO6/c1-28-14-7-6-13-24-18-9-3-5-11-20(18)30-21(23(24)27)12-15-29-19-10-4-2-8-17(19)16-22(25)26/h2-5,8-11,21H,6-7,12-16H2,1H3,(H,25,26)
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n/an/an/an/a 274n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138068
PNG
(CHEMBL174167 | {2-[2-(4-Methyl-3-oxo-3,4-dihydro-2...)
Show SMILES CN1C(=O)C(CCOc2ccccc2CC(O)=O)Oc2ccccc12
Show InChI InChI=1S/C19H19NO5/c1-20-14-7-3-5-9-16(14)25-17(19(20)23)10-11-24-15-8-4-2-6-13(15)12-18(21)22/h2-9,17H,10-12H2,1H3,(H,21,22)
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n/an/an/an/a>5.00E+3n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138069
PNG
((2-{2-[4-(5-Hydroxy-hexyl)-3-oxo-3,4-dihydro-2H-be...)
Show SMILES CC(O)CCCCN1C(=O)C(CCOc2ccccc2CC(O)=O)Oc2ccccc12
Show InChI InChI=1S/C24H29NO6/c1-17(26)8-6-7-14-25-19-10-3-5-12-21(19)31-22(24(25)29)13-15-30-20-11-4-2-9-18(20)16-23(27)28/h2-5,9-12,17,22,26H,6-8,13-16H2,1H3,(H,27,28)
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n/an/an/an/a 1.00E+3n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138071
PNG
((2-{2-[(S)-4-(5,5-Difluoro-hexyl)-3-oxo-3,4-dihydr...)
Show SMILES CC(F)(F)CCCCN1C(=O)[C@H](CCOc2ccccc2CC(O)=O)Oc2ccccc12
Show InChI InChI=1S/C24H27F2NO5/c1-24(25,26)13-6-7-14-27-18-9-3-5-11-20(18)32-21(23(27)30)12-15-31-19-10-4-2-8-17(19)16-22(28)29/h2-5,8-11,21H,6-7,12-16H2,1H3,(H,28,29)/t21-/m0/s1
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n/an/an/an/a 1.00E+3n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138070
PNG
((2-{2-[(R)-4-(6-Fluoro-hexyl)-3-oxo-3,4-dihydro-2H...)
Show SMILES OC(=O)Cc1ccccc1OCC[C@H]1Oc2ccccc2N(CCCCCCF)C1=O
Show InChI InChI=1S/C24H28FNO5/c25-14-7-1-2-8-15-26-19-10-4-6-12-21(19)31-22(24(26)29)13-16-30-20-11-5-3-9-18(20)17-23(27)28/h3-6,9-12,22H,1-2,7-8,13-17H2,(H,27,28)/t22-/m1/s1
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n/an/an/an/a 152n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138072
PNG
(CHEMBL176770 | {2-[2-(4-Heptyl-3-oxo-3,4-dihydro-2...)
Show SMILES CCCCCCCN1C(=O)C(CCOc2ccccc2CC(O)=O)Oc2ccccc12
Show InChI InChI=1S/C25H31NO5/c1-2-3-4-5-10-16-26-20-12-7-9-14-22(20)31-23(25(26)29)15-17-30-21-13-8-6-11-19(21)18-24(27)28/h6-9,11-14,23H,2-5,10,15-18H2,1H3,(H,27,28)
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n/an/an/an/a 234n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138073
PNG
((2-{2-[(R)-4-(5,5-Difluoro-hexyl)-3-oxo-3,4-dihydr...)
Show SMILES CC(F)(F)CCCCN1C(=O)[C@@H](CCOc2ccccc2CC(O)=O)Oc2ccccc12
Show InChI InChI=1S/C24H27F2NO5/c1-24(25,26)13-6-7-14-27-18-9-3-5-11-20(18)32-21(23(27)30)12-15-31-19-10-4-2-8-17(19)16-22(28)29/h2-5,8-11,21H,6-7,12-16H2,1H3,(H,28,29)/t21-/m1/s1
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n/an/an/an/a 295n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138076
PNG
((2-{2-[4-(4-Carbamoyl-butyl)-3-oxo-3,4-dihydro-2H-...)
Show SMILES NC(=O)CCCCN1C(=O)C(CCOc2ccccc2CC(O)=O)Oc2ccccc12
Show InChI InChI=1S/C23H26N2O6/c24-21(26)11-5-6-13-25-17-8-2-4-10-19(17)31-20(23(25)29)12-14-30-18-9-3-1-7-16(18)15-22(27)28/h1-4,7-10,20H,5-6,11-15H2,(H2,24,26)(H,27,28)
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n/an/an/an/a>5.00E+3n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138077
PNG
(6-{2-[2-(2-Carboxymethyl-phenoxy)-ethyl]-3-oxo-2,3...)
Show SMILES OC(=O)CCCCCN1C(=O)C(CCOc2ccccc2CC(O)=O)Oc2ccccc12
Show InChI InChI=1S/C24H27NO7/c26-22(27)12-2-1-7-14-25-18-9-4-6-11-20(18)32-21(24(25)30)13-15-31-19-10-5-3-8-17(19)16-23(28)29/h3-6,8-11,21H,1-2,7,12-16H2,(H,26,27)(H,28,29)
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n/an/an/an/a>5.00E+3n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138074
PNG
((2-{2-[4-(6-Fluoro-hexyl)-3-oxo-3,4-dihydro-2H-ben...)
Show SMILES OC(=O)Cc1ccccc1OCCC1Oc2ccccc2N(CCCCCCF)C1=O
Show InChI InChI=1S/C24H28FNO5/c25-14-7-1-2-8-15-26-19-10-4-6-12-21(19)31-22(24(26)29)13-16-30-20-11-5-3-9-18(20)17-23(27)28/h3-6,9-12,22H,1-2,7-8,13-17H2,(H,27,28)
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n/an/an/an/a 117n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138075
PNG
(CHEMBL174644 | {2-[2-(4-Isopropyl-3-oxo-3,4-dihydr...)
Show SMILES CC(C)N1C(=O)C(CCOc2ccccc2CC(O)=O)Oc2ccccc12
Show InChI InChI=1S/C21H23NO5/c1-14(2)22-16-8-4-6-10-18(16)27-19(21(22)25)11-12-26-17-9-5-3-7-15(17)13-20(23)24/h3-10,14,19H,11-13H2,1-2H3,(H,23,24)
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n/an/an/an/a>5.00E+3n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138079
PNG
(6-{2-[2-(2-Carboxymethyl-phenoxy)-ethyl]-3-oxo-2,3...)
Show SMILES CC(C)(CCCCN1C(=O)C(CCOc2ccccc2CC(O)=O)Oc2ccccc12)C(O)=O
Show InChI InChI=1S/C26H31NO7/c1-26(2,25(31)32)14-7-8-15-27-19-10-4-6-12-21(19)34-22(24(27)30)13-16-33-20-11-5-3-9-18(20)17-23(28)29/h3-6,9-12,22H,7-8,13-17H2,1-2H3,(H,28,29)(H,31,32)
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n/an/an/an/a 1.00E+3n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138078
PNG
(CHEMBL177830 | {2-[2-(4-Hex-5-enyl-3-oxo-3,4-dihyd...)
Show SMILES OC(=O)Cc1ccccc1OCCC1Oc2ccccc2N(CCCCC=C)C1=O
Show InChI InChI=1S/C24H27NO5/c1-2-3-4-9-15-25-19-11-6-8-13-21(19)30-22(24(25)28)14-16-29-20-12-7-5-10-18(20)17-23(26)27/h2,5-8,10-13,22H,1,3-4,9,14-17H2,(H,26,27)
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n/an/an/an/a 208n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138082
PNG
((2-{2-[4-(5-Hydroxy-5-methyl-hexyl)-3-oxo-3,4-dihy...)
Show SMILES CC(C)(O)CCCCN1C(=O)C(CCOc2ccccc2CC(O)=O)Oc2ccccc12
Show InChI InChI=1S/C25H31NO6/c1-25(2,30)14-7-8-15-26-19-10-4-6-12-21(19)32-22(24(26)29)13-16-31-20-11-5-3-9-18(20)17-23(27)28/h3-6,9-12,22,30H,7-8,13-17H2,1-2H3,(H,27,28)
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n/an/an/an/a 644n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138083
PNG
((2-{2-[3-Oxo-4-(5-oxo-hexyl)-3,4-dihydro-2H-benzo[...)
Show SMILES CC(=O)CCCCN1C(=O)C(CCOc2ccccc2CC(O)=O)Oc2ccccc12
Show InChI InChI=1S/C24H27NO6/c1-17(26)8-6-7-14-25-19-10-3-5-12-21(19)31-22(24(25)29)13-15-30-20-11-4-2-9-18(20)16-23(27)28/h2-5,9-12,22H,6-8,13-16H2,1H3,(H,27,28)
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n/an/an/an/a 260n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138085
PNG
(CHEMBL369054 | {2-[2-(4-Decyl-3-oxo-3,4-dihydro-2H...)
Show SMILES CCCCCCCCCCN1C(=O)C(CCOc2ccccc2CC(O)=O)Oc2ccccc12
Show InChI InChI=1S/C28H37NO5/c1-2-3-4-5-6-7-8-13-19-29-23-15-10-12-17-25(23)34-26(28(29)32)18-20-33-24-16-11-9-14-22(24)21-27(30)31/h9-12,14-17,26H,2-8,13,18-21H2,1H3,(H,30,31)
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n/an/an/an/a 1.00E+3n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138080
PNG
(CHEMBL176035 | {2-[2-(3-Oxo-4-propylcarbamoylmethy...)
Show SMILES CCCNC(=O)CN1C(=O)C(CCOc2ccccc2CC(O)=O)Oc2ccccc12
Show InChI InChI=1S/C23H26N2O6/c1-2-12-24-21(26)15-25-17-8-4-6-10-19(17)31-20(23(25)29)11-13-30-18-9-5-3-7-16(18)14-22(27)28/h3-10,20H,2,11-15H2,1H3,(H,24,26)(H,27,28)
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n/an/an/an/a>5.00E+3n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138081
PNG
((2-{2-[4-(3-Methylcarbamoyl-propyl)-3-oxo-3,4-dihy...)
Show SMILES CNC(=O)CCCN1C(=O)C(CCOc2ccccc2CC(O)=O)Oc2ccccc12
Show InChI InChI=1S/C23H26N2O6/c1-24-21(26)11-6-13-25-17-8-3-5-10-19(17)31-20(23(25)29)12-14-30-18-9-4-2-7-16(18)15-22(27)28/h2-5,7-10,20H,6,11-15H2,1H3,(H,24,26)(H,27,28)
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n/an/an/an/a>5.00E+3n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138084
PNG
(CHEMBL177439 | {2-[2-(2-Carboxymethyl-phenoxy)-eth...)
Show SMILES OC(=O)CN1C(=O)C(CCOc2ccccc2CC(O)=O)Oc2ccccc12
Show InChI InChI=1S/C20H19NO7/c22-18(23)11-13-5-1-3-7-15(13)27-10-9-17-20(26)21(12-19(24)25)14-6-2-4-8-16(14)28-17/h1-8,17H,9-12H2,(H,22,23)(H,24,25)
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n/an/an/an/a>5.00E+3n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138086
PNG
((2-{2-[4-(5-Cyano-5,5-dimethyl-pentyl)-3-oxo-3,4-d...)
Show SMILES CC(C)(CCCCN1C(=O)C(CCOc2ccccc2CC(O)=O)Oc2ccccc12)C#N
Show InChI InChI=1S/C26H30N2O5/c1-26(2,18-27)14-7-8-15-28-20-10-4-6-12-22(20)33-23(25(28)31)13-16-32-21-11-5-3-9-19(21)17-24(29)30/h3-6,9-12,23H,7-8,13-17H2,1-2H3,(H,29,30)
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n/an/an/an/a 359n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138087
PNG
(CHEMBL174906 | {2-[2-((S)-4-Hexyl-3-oxo-3,4-dihydr...)
Show SMILES CCCCCCN1C(=O)[C@H](CCOc2ccccc2CC(O)=O)Oc2ccccc12
Show InChI InChI=1S/C24H29NO5/c1-2-3-4-9-15-25-19-11-6-8-13-21(19)30-22(24(25)28)14-16-29-20-12-7-5-10-18(20)17-23(26)27/h5-8,10-13,22H,2-4,9,14-17H2,1H3,(H,26,27)/t22-/m0/s1
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n/an/an/an/a 1.20E+3n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138088
PNG
((2-{2-[3-Oxo-4-(6-oxo-heptyl)-3,4-dihydro-2H-benzo...)
Show SMILES CC(=O)CCCCCN1C(=O)C(CCOc2ccccc2CC(O)=O)Oc2ccccc12
Show InChI InChI=1S/C25H29NO6/c1-18(27)9-3-2-8-15-26-20-11-5-7-13-22(20)32-23(25(26)30)14-16-31-21-12-6-4-10-19(21)17-24(28)29/h4-7,10-13,23H,2-3,8-9,14-17H2,1H3,(H,28,29)
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n/an/an/an/a 264n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138090
PNG
((2-{2-[4-(6-Methanesulfonylamino-hexyl)-3-oxo-3,4-...)
Show SMILES CS(=O)(=O)NCCCCCCN1C(=O)C(CCOc2ccccc2CC(O)=O)Oc2ccccc12
Show InChI InChI=1S/C25H32N2O7S/c1-35(31,32)26-15-8-2-3-9-16-27-20-11-5-7-13-22(20)34-23(25(27)30)14-17-33-21-12-6-4-10-19(21)18-24(28)29/h4-7,10-13,23,26H,2-3,8-9,14-18H2,1H3,(H,28,29)
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n/an/an/an/a>5.00E+3n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138089
PNG
((2-{2-[4-(6,6-Difluoro-heptyl)-3-oxo-3,4-dihydro-2...)
Show SMILES CC(F)(F)CCCCCN1C(=O)C(CCOc2ccccc2CC(O)=O)Oc2ccccc12
Show InChI InChI=1S/C25H29F2NO5/c1-25(26,27)14-7-2-8-15-28-19-10-4-6-12-21(19)33-22(24(28)31)13-16-32-20-11-5-3-9-18(20)17-23(29)30/h3-6,9-12,22H,2,7-8,13-17H2,1H3,(H,29,30)
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n/an/an/an/a 534n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138091
PNG
((2-{2-[4-(6-Acetylamino-hexyl)-3-oxo-3,4-dihydro-2...)
Show SMILES CC(=O)NCCCCCCN1C(=O)C(CCOc2ccccc2CC(O)=O)Oc2ccccc12
Show InChI InChI=1S/C26H32N2O6/c1-19(29)27-15-8-2-3-9-16-28-21-11-5-7-13-23(21)34-24(26(28)32)14-17-33-22-12-6-4-10-20(22)18-25(30)31/h4-7,10-13,24H,2-3,8-9,14-18H2,1H3,(H,27,29)(H,30,31)
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n/an/an/an/a>5.00E+3n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138094
PNG
(CHEMBL177854 | {2-[2-(3-Oxo-4-pentyl-3,4-dihydro-2...)
Show SMILES CCCCCN1C(=O)C(CCOc2ccccc2CC(O)=O)Oc2ccccc12
Show InChI InChI=1S/C23H27NO5/c1-2-3-8-14-24-18-10-5-7-12-20(18)29-21(23(24)27)13-15-28-19-11-6-4-9-17(19)16-22(25)26/h4-7,9-12,21H,2-3,8,13-16H2,1H3,(H,25,26)
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n/an/an/an/a 243n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138092
PNG
((2-{2-[4-(6-Hydroxy-hexyl)-3-oxo-3,4-dihydro-2H-be...)
Show SMILES OCCCCCCN1C(=O)C(CCOc2ccccc2CC(O)=O)Oc2ccccc12
Show InChI InChI=1S/C24H29NO6/c26-15-8-2-1-7-14-25-19-10-4-6-12-21(19)31-22(24(25)29)13-16-30-20-11-5-3-9-18(20)17-23(27)28/h3-6,9-12,22,26H,1-2,7-8,13-17H2,(H,27,28)
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n/an/an/an/a 200n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138093
PNG
((2-{2-[4-(5,5-Dimethyl-hexyl)-3-oxo-3,4-dihydro-2H...)
Show SMILES CC(C)(C)CCCCN1C(=O)C(CCOc2ccccc2CC(O)=O)Oc2ccccc12
Show InChI InChI=1S/C26H33NO5/c1-26(2,3)15-8-9-16-27-20-11-5-7-13-22(20)32-23(25(27)30)14-17-31-21-12-6-4-10-19(21)18-24(28)29/h4-7,10-13,23H,8-9,14-18H2,1-3H3,(H,28,29)
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n/an/an/an/a 1.00E+3n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138096
PNG
((2-{2-[4-(5-Methyl-hexyl)-3-oxo-3,4-dihydro-2H-ben...)
Show SMILES CC(C)CCCCN1C(=O)C(CCOc2ccccc2CC(O)=O)Oc2ccccc12
Show InChI InChI=1S/C25H31NO5/c1-18(2)9-7-8-15-26-20-11-4-6-13-22(20)31-23(25(26)29)14-16-30-21-12-5-3-10-19(21)17-24(27)28/h3-6,10-13,18,23H,7-9,14-17H2,1-2H3,(H,27,28)
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n/an/an/an/a 79n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
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 120n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138095
PNG
((2-{2-[4-(7-Hydroxy-heptyl)-3-oxo-3,4-dihydro-2H-b...)
Show SMILES OCCCCCCCN1C(=O)C(CCOc2ccccc2CC(O)=O)Oc2ccccc12
Show InChI InChI=1S/C25H31NO6/c27-16-9-3-1-2-8-15-26-20-11-5-7-13-22(20)32-23(25(26)30)14-17-31-21-12-6-4-10-19(21)18-24(28)29/h4-7,10-13,23,27H,1-3,8-9,14-18H2,(H,28,29)
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n/an/an/an/a 149n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138100
PNG
(CHEMBL177454 | {2-[2-((R)-4-Hexyl-3-oxo-3,4-dihydr...)
Show SMILES CCCCCCN1C(=O)[C@@H](CCOc2ccccc2CC(O)=O)Oc2ccccc12
Show InChI InChI=1S/C24H29NO5/c1-2-3-4-9-15-25-19-11-6-8-13-21(19)30-22(24(25)28)14-16-29-20-12-7-5-10-18(20)17-23(26)27/h5-8,10-13,22H,2-4,9,14-17H2,1H3,(H,26,27)/t22-/m1/s1
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n/an/an/an/a 100n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138098
PNG
((2-{2-[3-Oxo-4-(2-propylsulfanyl-ethyl)-3,4-dihydr...)
Show SMILES CCCSCCN1C(=O)C(CCOc2ccccc2CC(O)=O)Oc2ccccc12
Show InChI InChI=1S/C23H27NO5S/c1-2-14-30-15-12-24-18-8-4-6-10-20(18)29-21(23(24)27)11-13-28-19-9-5-3-7-17(19)16-22(25)26/h3-10,21H,2,11-16H2,1H3,(H,25,26)
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n/an/an/an/a 380n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138097
PNG
((2-{2-[4-(2-Cyclohexyl-ethyl)-3-oxo-3,4-dihydro-2H...)
Show SMILES OC(=O)Cc1ccccc1OCCC1Oc2ccccc2N(CCC2CCCCC2)C1=O
Show InChI InChI=1S/C26H31NO5/c28-25(29)18-20-10-4-6-12-22(20)31-17-15-24-26(30)27(16-14-19-8-2-1-3-9-19)21-11-5-7-13-23(21)32-24/h4-7,10-13,19,24H,1-3,8-9,14-18H2,(H,28,29)
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n/an/an/an/a 300n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138099
PNG
(CHEMBL177395 | {2-[2-(4-Hexyl-3-oxo-3,4-dihydro-2H...)
Show SMILES CCCCCCN1C(=O)C(CCOc2ccccc2CC(O)=O)Oc2ccccc12
Show InChI InChI=1S/C24H29NO5/c1-2-3-4-9-15-25-19-11-6-8-13-21(19)30-22(24(25)28)14-16-29-20-12-7-5-10-18(20)17-23(26)27/h5-8,10-13,22H,2-4,9,14-17H2,1H3,(H,26,27)
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n/an/an/an/a 100n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138057
PNG
((2-{2-[4-(5-Hydroxy-pentyl)-3-oxo-3,4-dihydro-2H-b...)
Show SMILES OCCCCCN1C(=O)C(CCOc2ccccc2CC(O)=O)Oc2ccccc12
Show InChI InChI=1S/C23H27NO6/c25-14-7-1-6-13-24-18-9-3-5-11-20(18)30-21(23(24)28)12-15-29-19-10-4-2-8-17(19)16-22(26)27/h2-5,8-11,21,25H,1,6-7,12-16H2,(H,26,27)
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n/an/an/an/a 1.00E+3n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138056
PNG
((2-{2-[4-(5-Hydroxyimino-hexyl)-3-oxo-3,4-dihydro-...)
Show SMILES CC(CCCCN1C(=O)C(CCOc2ccccc2CC(O)=O)Oc2ccccc12)N=O
Show InChI InChI=1S/C24H28N2O6/c1-17(25-30)8-6-7-14-26-19-10-3-5-12-21(19)32-22(24(26)29)13-15-31-20-11-4-2-9-18(20)16-23(27)28/h2-5,9-12,17,22H,6-8,13-16H2,1H3,(H,27,28)
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n/an/an/an/a 10n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50138059
PNG
((2-{2-[(R)-4-(4-Methoxy-butyl)-3-oxo-3,4-dihydro-2...)
Show SMILES COCCCCN1C(=O)[C@@H](CCOc2ccccc2CC(O)=O)Oc2ccccc12
Show InChI InChI=1S/C23H27NO6/c1-28-14-7-6-13-24-18-9-3-5-11-20(18)30-21(23(24)27)12-15-29-19-10-4-2-8-17(19)16-22(25)26/h2-5,8-11,21H,6-7,12-16H2,1H3,(H,25,26)/t21-/m1/s1
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n/an/an/an/a 274n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair