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Compile Data Set for Download or QSAR

Found 48 hits with Last Name = 'takayama' and Initial = 'f'   
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
Solute carrier family 22 member 6


(Homo sapiens (Human))
BDBM50420185
PNG
(CHEMBL1233636)
Show SMILES OS(=O)(=O)Oc1c[nH]c2ccccc12
Show InChI InChI=1S/C8H7NO4S/c10-14(11,12)13-8-5-9-7-4-2-1-3-6(7)8/h1-5,9H,(H,10,11,12)
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2.27E+4n/an/an/an/an/an/an/an/a



Nagoya University School of Medicine

Curated by ChEMBL


Assay Description
TP_TRANSPORTER: inhibition of PAH uptake (PAH: 5 uM, indoxyl sulfate:500 uM) in S2 human-OAT1 expressing cells


Eur J Pharmacol 466: 13-20 (2003)


BindingDB Entry DOI: 10.7270/Q23R0V48
More data for this
Ligand-Target Pair
Solute carrier family 22 member 6


(Homo sapiens (Human))
BDBM50420185
PNG
(CHEMBL1233636)
Show SMILES OS(=O)(=O)Oc1c[nH]c2ccccc12
Show InChI InChI=1S/C8H7NO4S/c10-14(11,12)13-8-5-9-7-4-2-1-3-6(7)8/h1-5,9H,(H,10,11,12)
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2.30E+4n/an/an/an/an/an/an/an/a



Nagoya University School of Medicine

Curated by ChEMBL


Assay Description
TP_TRANSPORTER: uptake&inhibition of PAH in OAT1-S2 cells


Eur J Pharmacol 466: 13-20 (2003)


BindingDB Entry DOI: 10.7270/Q23R0V48
More data for this
Ligand-Target Pair
Solute carrier family 22 member 8


(Homo sapiens (Human))
BDBM50420185
PNG
(CHEMBL1233636)
Show SMILES OS(=O)(=O)Oc1c[nH]c2ccccc12
Show InChI InChI=1S/C8H7NO4S/c10-14(11,12)13-8-5-9-7-4-2-1-3-6(7)8/h1-5,9H,(H,10,11,12)
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1.69E+5n/an/an/an/an/an/an/an/a



Nagoya University School of Medicine

Curated by ChEMBL


Assay Description
TP_TRANSPORTER: inhibition of E1S uptake (E1S: 5 uM, indoxyl sulfate:500 uM) in S2 cells expressing human-OAT3


Eur J Pharmacol 466: 13-20 (2003)


BindingDB Entry DOI: 10.7270/Q23R0V48
More data for this
Ligand-Target Pair
Solute carrier family 22 member 8


(Homo sapiens (Human))
BDBM50420185
PNG
(CHEMBL1233636)
Show SMILES OS(=O)(=O)Oc1c[nH]c2ccccc12
Show InChI InChI=1S/C8H7NO4S/c10-14(11,12)13-8-5-9-7-4-2-1-3-6(7)8/h1-5,9H,(H,10,11,12)
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1.69E+5n/an/an/an/an/an/an/an/a



Nagoya University School of Medicine

Curated by ChEMBL


Assay Description
TP_TRANSPORTER: uptake&inhibition of estrone sulfate in OAT3-S2 cells


Eur J Pharmacol 466: 13-20 (2003)


BindingDB Entry DOI: 10.7270/Q23R0V48
More data for this
Ligand-Target Pair
Solute carrier family 22 member 11


(Homo sapiens (Human))
BDBM50420185
PNG
(CHEMBL1233636)
Show SMILES OS(=O)(=O)Oc1c[nH]c2ccccc12
Show InChI InChI=1S/C8H7NO4S/c10-14(11,12)13-8-5-9-7-4-2-1-3-6(7)8/h1-5,9H,(H,10,11,12)
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1.81E+5n/an/an/an/an/an/an/an/a



Nagoya University School of Medicine

Curated by ChEMBL


Assay Description
TP_TRANSPORTER: uptake&inhibition of estrone sulfate in OAT4-S2 cells


Eur J Pharmacol 466: 13-20 (2003)


BindingDB Entry DOI: 10.7270/Q23R0V48
More data for this
Ligand-Target Pair
Solute carrier family 22 member 11


(Homo sapiens (Human))
BDBM50420185
PNG
(CHEMBL1233636)
Show SMILES OS(=O)(=O)Oc1c[nH]c2ccccc12
Show InChI InChI=1S/C8H7NO4S/c10-14(11,12)13-8-5-9-7-4-2-1-3-6(7)8/h1-5,9H,(H,10,11,12)
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1.81E+5n/an/an/an/an/an/an/an/a



Nagoya University School of Medicine

Curated by ChEMBL


Assay Description
TP_TRANSPORTER: inhibition of E1S uptake (E1S: 5 uM, indoxyl sulfate:500 uM) in S2 cells expressing human-OAT4


Eur J Pharmacol 466: 13-20 (2003)


BindingDB Entry DOI: 10.7270/Q23R0V48
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50344337
PNG
(CHEMBL1779478 | rac-2-(3-((4-(Benzyloxy)benzamido)...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccc(OCc3ccccc3)cc2)c1)C(O)=O
Show InChI InChI=1S/C27H29NO5/c1-3-21(27(30)31)15-20-9-14-25(32-2)23(16-20)17-28-26(29)22-10-12-24(13-11-22)33-18-19-7-5-4-6-8-19/h4-14,16,21H,3,15,17-18H2,1-2H3,(H,28,29)(H,30,31)
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n/an/an/an/a 52n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-fussed PPARalpha expressed in human HEK293 cells by reporter gene assay


Bioorg Med Chem 19: 3183-91 (2011)


Article DOI: 10.1016/j.bmc.2011.03.064
BindingDB Entry DOI: 10.7270/Q2S75GNC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50344338
PNG
(CHEMBL1779479 | rac-2-(4-Methoxy-3-((4-phenethoxyb...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccc(OCCc3ccccc3)cc2)c1)C(O)=O
Show InChI InChI=1S/C28H31NO5/c1-3-22(28(31)32)17-21-9-14-26(33-2)24(18-21)19-29-27(30)23-10-12-25(13-11-23)34-16-15-20-7-5-4-6-8-20/h4-14,18,22H,3,15-17,19H2,1-2H3,(H,29,30)(H,31,32)
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n/an/an/an/a 60n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-fussed PPARalpha expressed in human HEK293 cells by reporter gene assay


Bioorg Med Chem 19: 3183-91 (2011)


Article DOI: 10.1016/j.bmc.2011.03.064
BindingDB Entry DOI: 10.7270/Q2S75GNC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50344339
PNG
(CHEMBL1779476 | rac-2-(4-Methoxy-3-((3-phenylbenza...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2cccc(c2)-c2ccccc2)c1)C(O)=O
Show InChI InChI=1S/C26H27NO4/c1-3-19(26(29)30)14-18-12-13-24(31-2)23(15-18)17-27-25(28)22-11-7-10-21(16-22)20-8-5-4-6-9-20/h4-13,15-16,19H,3,14,17H2,1-2H3,(H,27,28)(H,29,30)
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n/an/an/an/a 74n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-fussed PPARalpha expressed in human HEK293 cells by reporter gene assay


Bioorg Med Chem 19: 3183-91 (2011)


Article DOI: 10.1016/j.bmc.2011.03.064
BindingDB Entry DOI: 10.7270/Q2S75GNC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50344340
PNG
(CHEMBL255392 | rac-2-(3-(4-Methylbenzamidomethyl)-...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccc(C)cc2)c1)C(O)=O |w:2.2|
Show InChI InChI=1S/C21H25NO4/c1-4-16(21(24)25)11-15-7-10-19(26-3)18(12-15)13-22-20(23)17-8-5-14(2)6-9-17/h5-10,12,16H,4,11,13H2,1-3H3,(H,22,23)(H,24,25)
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n/an/an/an/a 100n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-fussed PPARalpha expressed in human HEK293 cells by reporter gene assay


Bioorg Med Chem 19: 3183-91 (2011)


Article DOI: 10.1016/j.bmc.2011.03.064
BindingDB Entry DOI: 10.7270/Q2S75GNC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50344333
PNG
(CHEMBL1779473 | rac-2-(4-Methoxy-3-((4-(trifluorom...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccc(OC(F)(F)F)cc2)c1)C(O)=O
Show InChI InChI=1S/C21H22F3NO5/c1-3-14(20(27)28)10-13-4-9-18(29-2)16(11-13)12-25-19(26)15-5-7-17(8-6-15)30-21(22,23)24/h4-9,11,14H,3,10,12H2,1-2H3,(H,25,26)(H,27,28)
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n/an/an/an/a 110n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-fussed PPARdelta expressed in human HEK293 cells by reporter gene assay


Bioorg Med Chem 19: 3183-91 (2011)


Article DOI: 10.1016/j.bmc.2011.03.064
BindingDB Entry DOI: 10.7270/Q2S75GNC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50344332
PNG
(2-(4-methoxy-3-((4-phenoxybenzamido)methyl)benzyl)...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccc(Oc3ccccc3)cc2)c1)C(O)=O
Show InChI InChI=1S/C26H27NO5/c1-3-19(26(29)30)15-18-9-14-24(31-2)21(16-18)17-27-25(28)20-10-12-23(13-11-20)32-22-7-5-4-6-8-22/h4-14,16,19H,3,15,17H2,1-2H3,(H,27,28)(H,29,30)
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n/an/an/an/a 120n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-fussed PPARdelta expressed in human HEK293 cells by reporter gene assay


Bioorg Med Chem 19: 3183-91 (2011)


Article DOI: 10.1016/j.bmc.2011.03.064
BindingDB Entry DOI: 10.7270/Q2S75GNC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50344331
PNG
(CHEMBL270587 | rac-2-(3-{[(biphenyl-4-carbonyl)-am...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccc(cc2)-c2ccccc2)c1)C(O)=O |w:2.2|
Show InChI InChI=1S/C26H27NO4/c1-3-19(26(29)30)15-18-9-14-24(31-2)23(16-18)17-27-25(28)22-12-10-21(11-13-22)20-7-5-4-6-8-20/h4-14,16,19H,3,15,17H2,1-2H3,(H,27,28)(H,29,30)
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n/an/an/an/a 210n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-fussed PPARdelta expressed in human HEK293 cells by reporter gene assay


Bioorg Med Chem 19: 3183-91 (2011)


Article DOI: 10.1016/j.bmc.2011.03.064
BindingDB Entry DOI: 10.7270/Q2S75GNC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50344330
PNG
((S)-2-(3-((4-(4-Fluorophenoxy)benzamido)methyl)-4-...)
Show SMILES CC[C@@H](Cc1ccc(OC)c(CNC(=O)c2ccc(Oc3ccc(F)cc3)cc2)c1)C(O)=O |r|
Show InChI InChI=1S/C26H26FNO5/c1-3-18(26(30)31)14-17-4-13-24(32-2)20(15-17)16-28-25(29)19-5-9-22(10-6-19)33-23-11-7-21(27)8-12-23/h4-13,15,18H,3,14,16H2,1-2H3,(H,28,29)(H,30,31)/t18-/m0/s1
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n/an/an/an/a 300n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-fussed PPARdelta expressed in human HEK293 cells by reporter gene assay


Bioorg Med Chem 19: 3183-91 (2011)


Article DOI: 10.1016/j.bmc.2011.03.064
BindingDB Entry DOI: 10.7270/Q2S75GNC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50344331
PNG
(CHEMBL270587 | rac-2-(3-{[(biphenyl-4-carbonyl)-am...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccc(cc2)-c2ccccc2)c1)C(O)=O |w:2.2|
Show InChI InChI=1S/C26H27NO4/c1-3-19(26(29)30)15-18-9-14-24(31-2)23(16-18)17-27-25(28)22-12-10-21(11-13-22)20-7-5-4-6-8-20/h4-14,16,19H,3,15,17H2,1-2H3,(H,27,28)(H,29,30)
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n/an/an/an/a 340n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-fussed PPARgamma expressed in human HEK293 cells by reporter gene assay


Bioorg Med Chem 19: 3183-91 (2011)


Article DOI: 10.1016/j.bmc.2011.03.064
BindingDB Entry DOI: 10.7270/Q2S75GNC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50344340
PNG
(CHEMBL255392 | rac-2-(3-(4-Methylbenzamidomethyl)-...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccc(C)cc2)c1)C(O)=O |w:2.2|
Show InChI InChI=1S/C21H25NO4/c1-4-16(21(24)25)11-15-7-10-19(26-3)18(12-15)13-22-20(23)17-8-5-14(2)6-9-17/h5-10,12,16H,4,11,13H2,1-3H3,(H,22,23)(H,24,25)
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n/an/an/an/a 360n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-fussed PPARdelta expressed in human HEK293 cells by reporter gene assay


Bioorg Med Chem 19: 3183-91 (2011)


Article DOI: 10.1016/j.bmc.2011.03.064
BindingDB Entry DOI: 10.7270/Q2S75GNC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50344337
PNG
(CHEMBL1779478 | rac-2-(3-((4-(Benzyloxy)benzamido)...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccc(OCc3ccccc3)cc2)c1)C(O)=O
Show InChI InChI=1S/C27H29NO5/c1-3-21(27(30)31)15-20-9-14-25(32-2)23(16-20)17-28-26(29)22-10-12-24(13-11-22)33-18-19-7-5-4-6-8-19/h4-14,16,21H,3,15,17-18H2,1-2H3,(H,28,29)(H,30,31)
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Okayama University

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-fussed PPARgamma expressed in human HEK293 cells by reporter gene assay


Bioorg Med Chem 19: 3183-91 (2011)


Article DOI: 10.1016/j.bmc.2011.03.064
BindingDB Entry DOI: 10.7270/Q2S75GNC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50344334
PNG
((S)-2-(3-((4-(4-Chlorophenoxy)benzamido)methyl)-4-...)
Show SMILES CC[C@@H](Cc1ccc(OC)c(CNC(=O)c2ccc(Oc3ccc(Cl)cc3)cc2)c1)C(O)=O |r|
Show InChI InChI=1S/C26H26ClNO5/c1-3-18(26(30)31)14-17-4-13-24(32-2)20(15-17)16-28-25(29)19-5-9-22(10-6-19)33-23-11-7-21(27)8-12-23/h4-13,15,18H,3,14,16H2,1-2H3,(H,28,29)(H,30,31)/t18-/m0/s1
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Okayama University

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-fussed PPARdelta expressed in human HEK293 cells by reporter gene assay


Bioorg Med Chem 19: 3183-91 (2011)


Article DOI: 10.1016/j.bmc.2011.03.064
BindingDB Entry DOI: 10.7270/Q2S75GNC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50344339
PNG
(CHEMBL1779476 | rac-2-(4-Methoxy-3-((3-phenylbenza...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2cccc(c2)-c2ccccc2)c1)C(O)=O
Show InChI InChI=1S/C26H27NO4/c1-3-19(26(29)30)14-18-12-13-24(31-2)23(15-18)17-27-25(28)22-11-7-10-21(16-22)20-8-5-4-6-9-20/h4-13,15-16,19H,3,14,17H2,1-2H3,(H,27,28)(H,29,30)
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n/an/an/an/a 710n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-fussed PPARgamma expressed in human HEK293 cells by reporter gene assay


Bioorg Med Chem 19: 3183-91 (2011)


Article DOI: 10.1016/j.bmc.2011.03.064
BindingDB Entry DOI: 10.7270/Q2S75GNC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50344338
PNG
(CHEMBL1779479 | rac-2-(4-Methoxy-3-((4-phenethoxyb...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccc(OCCc3ccccc3)cc2)c1)C(O)=O
Show InChI InChI=1S/C28H31NO5/c1-3-22(28(31)32)17-21-9-14-26(33-2)24(18-21)19-29-27(30)23-10-12-25(13-11-23)34-16-15-20-7-5-4-6-8-20/h4-14,18,22H,3,15-17,19H2,1-2H3,(H,29,30)(H,31,32)
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n/an/an/an/a 780n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-fussed PPARgamma expressed in human HEK293 cells by reporter gene assay


Bioorg Med Chem 19: 3183-91 (2011)


Article DOI: 10.1016/j.bmc.2011.03.064
BindingDB Entry DOI: 10.7270/Q2S75GNC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50344335
PNG
((S)-2-(3-((4-(4-bromophenoxy)benzamido)methyl)-4-m...)
Show SMILES CC[C@@H](Cc1ccc(OC)c(CNC(=O)c2ccc(Oc3ccc(Br)cc3)cc2)c1)C(O)=O |r|
Show InChI InChI=1S/C26H26BrNO5/c1-3-18(26(30)31)14-17-4-13-24(32-2)20(15-17)16-28-25(29)19-5-9-22(10-6-19)33-23-11-7-21(27)8-12-23/h4-13,15,18H,3,14,16H2,1-2H3,(H,28,29)(H,30,31)/t18-/m0/s1
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n/an/an/an/a 800n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-fussed PPARdelta expressed in human HEK293 cells by reporter gene assay


Bioorg Med Chem 19: 3183-91 (2011)


Article DOI: 10.1016/j.bmc.2011.03.064
BindingDB Entry DOI: 10.7270/Q2S75GNC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50344332
PNG
(2-(4-methoxy-3-((4-phenoxybenzamido)methyl)benzyl)...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccc(Oc3ccccc3)cc2)c1)C(O)=O
Show InChI InChI=1S/C26H27NO5/c1-3-19(26(29)30)15-18-9-14-24(31-2)21(16-18)17-27-25(28)20-10-12-23(13-11-20)32-22-7-5-4-6-8-22/h4-14,16,19H,3,15,17H2,1-2H3,(H,27,28)(H,29,30)
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n/an/an/an/a 820n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-fussed PPARgamma expressed in human HEK293 cells by reporter gene assay


Bioorg Med Chem 19: 3183-91 (2011)


Article DOI: 10.1016/j.bmc.2011.03.064
BindingDB Entry DOI: 10.7270/Q2S75GNC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50344334
PNG
((S)-2-(3-((4-(4-Chlorophenoxy)benzamido)methyl)-4-...)
Show SMILES CC[C@@H](Cc1ccc(OC)c(CNC(=O)c2ccc(Oc3ccc(Cl)cc3)cc2)c1)C(O)=O |r|
Show InChI InChI=1S/C26H26ClNO5/c1-3-18(26(30)31)14-17-4-13-24(32-2)20(15-17)16-28-25(29)19-5-9-22(10-6-19)33-23-11-7-21(27)8-12-23/h4-13,15,18H,3,14,16H2,1-2H3,(H,28,29)(H,30,31)/t18-/m0/s1
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n/an/an/an/a 830n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-fussed PPARgamma expressed in human HEK293 cells by reporter gene assay


Bioorg Med Chem 19: 3183-91 (2011)


Article DOI: 10.1016/j.bmc.2011.03.064
BindingDB Entry DOI: 10.7270/Q2S75GNC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50344330
PNG
((S)-2-(3-((4-(4-Fluorophenoxy)benzamido)methyl)-4-...)
Show SMILES CC[C@@H](Cc1ccc(OC)c(CNC(=O)c2ccc(Oc3ccc(F)cc3)cc2)c1)C(O)=O |r|
Show InChI InChI=1S/C26H26FNO5/c1-3-18(26(30)31)14-17-4-13-24(32-2)20(15-17)16-28-25(29)19-5-9-22(10-6-19)33-23-11-7-21(27)8-12-23/h4-13,15,18H,3,14,16H2,1-2H3,(H,28,29)(H,30,31)/t18-/m0/s1
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n/an/an/an/a 920n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-fussed PPARgamma expressed in human HEK293 cells by reporter gene assay


Bioorg Med Chem 19: 3183-91 (2011)


Article DOI: 10.1016/j.bmc.2011.03.064
BindingDB Entry DOI: 10.7270/Q2S75GNC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50344335
PNG
((S)-2-(3-((4-(4-bromophenoxy)benzamido)methyl)-4-m...)
Show SMILES CC[C@@H](Cc1ccc(OC)c(CNC(=O)c2ccc(Oc3ccc(Br)cc3)cc2)c1)C(O)=O |r|
Show InChI InChI=1S/C26H26BrNO5/c1-3-18(26(30)31)14-17-4-13-24(32-2)20(15-17)16-28-25(29)19-5-9-22(10-6-19)33-23-11-7-21(27)8-12-23/h4-13,15,18H,3,14,16H2,1-2H3,(H,28,29)(H,30,31)/t18-/m0/s1
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n/an/an/an/a 990n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-fussed PPARgamma expressed in human HEK293 cells by reporter gene assay


Bioorg Med Chem 19: 3183-91 (2011)


Article DOI: 10.1016/j.bmc.2011.03.064
BindingDB Entry DOI: 10.7270/Q2S75GNC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50344337
PNG
(CHEMBL1779478 | rac-2-(3-((4-(Benzyloxy)benzamido)...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccc(OCc3ccccc3)cc2)c1)C(O)=O
Show InChI InChI=1S/C27H29NO5/c1-3-21(27(30)31)15-20-9-14-25(32-2)23(16-20)17-28-26(29)22-10-12-24(13-11-22)33-18-19-7-5-4-6-8-19/h4-14,16,21H,3,15,17-18H2,1-2H3,(H,28,29)(H,30,31)
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n/an/an/an/a 1.40E+3n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-fussed PPARdelta expressed in human HEK293 cells by reporter gene assay


Bioorg Med Chem 19: 3183-91 (2011)


Article DOI: 10.1016/j.bmc.2011.03.064
BindingDB Entry DOI: 10.7270/Q2S75GNC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50344338
PNG
(CHEMBL1779479 | rac-2-(4-Methoxy-3-((4-phenethoxyb...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccc(OCCc3ccccc3)cc2)c1)C(O)=O
Show InChI InChI=1S/C28H31NO5/c1-3-22(28(31)32)17-21-9-14-26(33-2)24(18-21)19-29-27(30)23-10-12-25(13-11-23)34-16-15-20-7-5-4-6-8-20/h4-14,18,22H,3,15-17,19H2,1-2H3,(H,29,30)(H,31,32)
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n/an/an/an/a 1.40E+3n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-fussed PPARdelta expressed in human HEK293 cells by reporter gene assay


Bioorg Med Chem 19: 3183-91 (2011)


Article DOI: 10.1016/j.bmc.2011.03.064
BindingDB Entry DOI: 10.7270/Q2S75GNC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50344341
PNG
(CHEMBL255593 | rac-2-(3-(benzamidomethyl)-4-methox...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccccc2)c1)C(O)=O |w:2.2|
Show InChI InChI=1S/C20H23NO4/c1-3-15(20(23)24)11-14-9-10-18(25-2)17(12-14)13-21-19(22)16-7-5-4-6-8-16/h4-10,12,15H,3,11,13H2,1-2H3,(H,21,22)(H,23,24)
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n/an/an/an/a 1.70E+3n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-fussed PPARalpha expressed in human HEK293 cells by reporter gene assay


Bioorg Med Chem 19: 3183-91 (2011)


Article DOI: 10.1016/j.bmc.2011.03.064
BindingDB Entry DOI: 10.7270/Q2S75GNC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50344342
PNG
(CHEMBL1779475 | rac-2-(4-Methoxy-3-((2-phenoxybenz...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccccc2Oc2ccccc2)c1)C(O)=O
Show InChI InChI=1S/C26H27NO5/c1-3-19(26(29)30)15-18-13-14-23(31-2)20(16-18)17-27-25(28)22-11-7-8-12-24(22)32-21-9-5-4-6-10-21/h4-14,16,19H,3,15,17H2,1-2H3,(H,27,28)(H,29,30)
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n/an/an/an/a 3.60E+3n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-fussed PPARalpha expressed in human HEK293 cells by reporter gene assay


Bioorg Med Chem 19: 3183-91 (2011)


Article DOI: 10.1016/j.bmc.2011.03.064
BindingDB Entry DOI: 10.7270/Q2S75GNC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50344343
PNG
(CHEMBL1779477 | rac-2-(4-Methoxy-3-((2-phenylbenza...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccccc2-c2ccccc2)c1)C(O)=O
Show InChI InChI=1S/C26H27NO4/c1-3-19(26(29)30)15-18-13-14-24(31-2)21(16-18)17-27-25(28)23-12-8-7-11-22(23)20-9-5-4-6-10-20/h4-14,16,19H,3,15,17H2,1-2H3,(H,27,28)(H,29,30)
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n/an/an/an/a 3.60E+3n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-fussed PPARalpha expressed in human HEK293 cells by reporter gene assay


Bioorg Med Chem 19: 3183-91 (2011)


Article DOI: 10.1016/j.bmc.2011.03.064
BindingDB Entry DOI: 10.7270/Q2S75GNC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50344339
PNG
(CHEMBL1779476 | rac-2-(4-Methoxy-3-((3-phenylbenza...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2cccc(c2)-c2ccccc2)c1)C(O)=O
Show InChI InChI=1S/C26H27NO4/c1-3-19(26(29)30)14-18-12-13-24(31-2)23(15-18)17-27-25(28)22-11-7-10-21(16-22)20-8-5-4-6-9-20/h4-13,15-16,19H,3,14,17H2,1-2H3,(H,27,28)(H,29,30)
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n/an/an/an/a 4.10E+3n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-fussed PPARdelta expressed in human HEK293 cells by reporter gene assay


Bioorg Med Chem 19: 3183-91 (2011)


Article DOI: 10.1016/j.bmc.2011.03.064
BindingDB Entry DOI: 10.7270/Q2S75GNC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50344333
PNG
(CHEMBL1779473 | rac-2-(4-Methoxy-3-((4-(trifluorom...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccc(OC(F)(F)F)cc2)c1)C(O)=O
Show InChI InChI=1S/C21H22F3NO5/c1-3-14(20(27)28)10-13-4-9-18(29-2)16(11-13)12-25-19(26)15-5-7-17(8-6-15)30-21(22,23)24/h4-9,11,14H,3,10,12H2,1-2H3,(H,25,26)(H,27,28)
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n/an/an/an/a 4.40E+3n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-fussed PPARgamma expressed in human HEK293 cells by reporter gene assay


Bioorg Med Chem 19: 3183-91 (2011)


Article DOI: 10.1016/j.bmc.2011.03.064
BindingDB Entry DOI: 10.7270/Q2S75GNC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50344336
PNG
(CHEMBL1779474 | rac-2-(4-Methoxy-3-((3-phenoxybenz...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2cccc(Oc3ccccc3)c2)c1)C(O)=O
Show InChI InChI=1S/C26H27NO5/c1-3-19(26(29)30)14-18-12-13-24(31-2)21(15-18)17-27-25(28)20-8-7-11-23(16-20)32-22-9-5-4-6-10-22/h4-13,15-16,19H,3,14,17H2,1-2H3,(H,27,28)(H,29,30)
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n/an/an/an/a 4.60E+3n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-fussed PPARgamma expressed in human HEK293 cells by reporter gene assay


Bioorg Med Chem 19: 3183-91 (2011)


Article DOI: 10.1016/j.bmc.2011.03.064
BindingDB Entry DOI: 10.7270/Q2S75GNC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50344336
PNG
(CHEMBL1779474 | rac-2-(4-Methoxy-3-((3-phenoxybenz...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2cccc(Oc3ccccc3)c2)c1)C(O)=O
Show InChI InChI=1S/C26H27NO5/c1-3-19(26(29)30)14-18-12-13-24(31-2)21(15-18)17-27-25(28)20-8-7-11-23(16-20)32-22-9-5-4-6-10-22/h4-13,15-16,19H,3,14,17H2,1-2H3,(H,27,28)(H,29,30)
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n/an/an/an/a 4.80E+3n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-fussed PPARdelta expressed in human HEK293 cells by reporter gene assay


Bioorg Med Chem 19: 3183-91 (2011)


Article DOI: 10.1016/j.bmc.2011.03.064
BindingDB Entry DOI: 10.7270/Q2S75GNC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50344341
PNG
(CHEMBL255593 | rac-2-(3-(benzamidomethyl)-4-methox...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccccc2)c1)C(O)=O |w:2.2|
Show InChI InChI=1S/C20H23NO4/c1-3-15(20(23)24)11-14-9-10-18(25-2)17(12-14)13-21-19(22)16-7-5-4-6-8-16/h4-10,12,15H,3,11,13H2,1-2H3,(H,21,22)(H,23,24)
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n/an/an/an/a 8.10E+3n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-fussed PPARdelta expressed in human HEK293 cells by reporter gene assay


Bioorg Med Chem 19: 3183-91 (2011)


Article DOI: 10.1016/j.bmc.2011.03.064
BindingDB Entry DOI: 10.7270/Q2S75GNC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50344340
PNG
(CHEMBL255392 | rac-2-(3-(4-Methylbenzamidomethyl)-...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccc(C)cc2)c1)C(O)=O |w:2.2|
Show InChI InChI=1S/C21H25NO4/c1-4-16(21(24)25)11-15-7-10-19(26-3)18(12-15)13-22-20(23)17-8-5-14(2)6-9-17/h5-10,12,16H,4,11,13H2,1-3H3,(H,22,23)(H,24,25)
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n/an/an/an/a 9.60E+3n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-fussed PPARgamma expressed in human HEK293 cells by reporter gene assay


Bioorg Med Chem 19: 3183-91 (2011)


Article DOI: 10.1016/j.bmc.2011.03.064
BindingDB Entry DOI: 10.7270/Q2S75GNC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50344342
PNG
(CHEMBL1779475 | rac-2-(4-Methoxy-3-((2-phenoxybenz...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccccc2Oc2ccccc2)c1)C(O)=O
Show InChI InChI=1S/C26H27NO5/c1-3-19(26(29)30)15-18-13-14-23(31-2)20(16-18)17-27-25(28)22-11-7-8-12-24(22)32-21-9-5-4-6-10-21/h4-14,16,19H,3,15,17H2,1-2H3,(H,27,28)(H,29,30)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-fussed PPARdelta expressed in human HEK293 cells by reporter gene assay


Bioorg Med Chem 19: 3183-91 (2011)


Article DOI: 10.1016/j.bmc.2011.03.064
BindingDB Entry DOI: 10.7270/Q2S75GNC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50344343
PNG
(CHEMBL1779477 | rac-2-(4-Methoxy-3-((2-phenylbenza...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccccc2-c2ccccc2)c1)C(O)=O
Show InChI InChI=1S/C26H27NO4/c1-3-19(26(29)30)15-18-13-14-24(31-2)21(16-18)17-27-25(28)23-12-8-7-11-22(23)20-9-5-4-6-10-20/h4-14,16,19H,3,15,17H2,1-2H3,(H,27,28)(H,29,30)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-fussed PPARdelta expressed in human HEK293 cells by reporter gene assay


Bioorg Med Chem 19: 3183-91 (2011)


Article DOI: 10.1016/j.bmc.2011.03.064
BindingDB Entry DOI: 10.7270/Q2S75GNC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50344341
PNG
(CHEMBL255593 | rac-2-(3-(benzamidomethyl)-4-methox...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccccc2)c1)C(O)=O |w:2.2|
Show InChI InChI=1S/C20H23NO4/c1-3-15(20(23)24)11-14-9-10-18(25-2)17(12-14)13-21-19(22)16-7-5-4-6-8-16/h4-10,12,15H,3,11,13H2,1-2H3,(H,21,22)(H,23,24)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-fussed PPARgamma expressed in human HEK293 cells by reporter gene assay


Bioorg Med Chem 19: 3183-91 (2011)


Article DOI: 10.1016/j.bmc.2011.03.064
BindingDB Entry DOI: 10.7270/Q2S75GNC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50344342
PNG
(CHEMBL1779475 | rac-2-(4-Methoxy-3-((2-phenoxybenz...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccccc2Oc2ccccc2)c1)C(O)=O
Show InChI InChI=1S/C26H27NO5/c1-3-19(26(29)30)15-18-13-14-23(31-2)20(16-18)17-27-25(28)22-11-7-8-12-24(22)32-21-9-5-4-6-10-21/h4-14,16,19H,3,15,17H2,1-2H3,(H,27,28)(H,29,30)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-fussed PPARgamma expressed in human HEK293 cells by reporter gene assay


Bioorg Med Chem 19: 3183-91 (2011)


Article DOI: 10.1016/j.bmc.2011.03.064
BindingDB Entry DOI: 10.7270/Q2S75GNC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50344343
PNG
(CHEMBL1779477 | rac-2-(4-Methoxy-3-((2-phenylbenza...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccccc2-c2ccccc2)c1)C(O)=O
Show InChI InChI=1S/C26H27NO4/c1-3-19(26(29)30)15-18-13-14-24(31-2)21(16-18)17-27-25(28)23-12-8-7-11-22(23)20-9-5-4-6-10-20/h4-14,16,19H,3,15,17H2,1-2H3,(H,27,28)(H,29,30)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-fussed PPARgamma expressed in human HEK293 cells by reporter gene assay


Bioorg Med Chem 19: 3183-91 (2011)


Article DOI: 10.1016/j.bmc.2011.03.064
BindingDB Entry DOI: 10.7270/Q2S75GNC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50344336
PNG
(CHEMBL1779474 | rac-2-(4-Methoxy-3-((3-phenoxybenz...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2cccc(Oc3ccccc3)c2)c1)C(O)=O
Show InChI InChI=1S/C26H27NO5/c1-3-19(26(29)30)14-18-12-13-24(31-2)21(15-18)17-27-25(28)20-8-7-11-23(16-20)32-22-9-5-4-6-10-22/h4-13,15-16,19H,3,14,17H2,1-2H3,(H,27,28)(H,29,30)
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n/an/an/an/a 41n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-fussed PPARalpha expressed in human HEK293 cells by reporter gene assay


Bioorg Med Chem 19: 3183-91 (2011)


Article DOI: 10.1016/j.bmc.2011.03.064
BindingDB Entry DOI: 10.7270/Q2S75GNC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50344335
PNG
((S)-2-(3-((4-(4-bromophenoxy)benzamido)methyl)-4-m...)
Show SMILES CC[C@@H](Cc1ccc(OC)c(CNC(=O)c2ccc(Oc3ccc(Br)cc3)cc2)c1)C(O)=O |r|
Show InChI InChI=1S/C26H26BrNO5/c1-3-18(26(30)31)14-17-4-13-24(32-2)20(15-17)16-28-25(29)19-5-9-22(10-6-19)33-23-11-7-21(27)8-12-23/h4-13,15,18H,3,14,16H2,1-2H3,(H,28,29)(H,30,31)/t18-/m0/s1
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n/an/an/an/a 29n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-fussed PPARalpha expressed in human HEK293 cells by reporter gene assay


Bioorg Med Chem 19: 3183-91 (2011)


Article DOI: 10.1016/j.bmc.2011.03.064
BindingDB Entry DOI: 10.7270/Q2S75GNC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50344334
PNG
((S)-2-(3-((4-(4-Chlorophenoxy)benzamido)methyl)-4-...)
Show SMILES CC[C@@H](Cc1ccc(OC)c(CNC(=O)c2ccc(Oc3ccc(Cl)cc3)cc2)c1)C(O)=O |r|
Show InChI InChI=1S/C26H26ClNO5/c1-3-18(26(30)31)14-17-4-13-24(32-2)20(15-17)16-28-25(29)19-5-9-22(10-6-19)33-23-11-7-21(27)8-12-23/h4-13,15,18H,3,14,16H2,1-2H3,(H,28,29)(H,30,31)/t18-/m0/s1
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n/an/an/an/a 15n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-fussed PPARalpha expressed in human HEK293 cells by reporter gene assay


Bioorg Med Chem 19: 3183-91 (2011)


Article DOI: 10.1016/j.bmc.2011.03.064
BindingDB Entry DOI: 10.7270/Q2S75GNC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50344333
PNG
(CHEMBL1779473 | rac-2-(4-Methoxy-3-((4-(trifluorom...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccc(OC(F)(F)F)cc2)c1)C(O)=O
Show InChI InChI=1S/C21H22F3NO5/c1-3-14(20(27)28)10-13-4-9-18(29-2)16(11-13)12-25-19(26)15-5-7-17(8-6-15)30-21(22,23)24/h4-9,11,14H,3,10,12H2,1-2H3,(H,25,26)(H,27,28)
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n/an/an/an/a 12n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-fussed PPARalpha expressed in human HEK293 cells by reporter gene assay


Bioorg Med Chem 19: 3183-91 (2011)


Article DOI: 10.1016/j.bmc.2011.03.064
BindingDB Entry DOI: 10.7270/Q2S75GNC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50344332
PNG
(2-(4-methoxy-3-((4-phenoxybenzamido)methyl)benzyl)...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccc(Oc3ccccc3)cc2)c1)C(O)=O
Show InChI InChI=1S/C26H27NO5/c1-3-19(26(29)30)15-18-9-14-24(31-2)21(16-18)17-27-25(28)20-10-12-23(13-11-20)32-22-7-5-4-6-8-22/h4-14,16,19H,3,15,17H2,1-2H3,(H,27,28)(H,29,30)
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n/an/an/an/a 8.80n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-fussed PPARalpha expressed in human HEK293 cells by reporter gene assay


Bioorg Med Chem 19: 3183-91 (2011)


Article DOI: 10.1016/j.bmc.2011.03.064
BindingDB Entry DOI: 10.7270/Q2S75GNC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50344330
PNG
((S)-2-(3-((4-(4-Fluorophenoxy)benzamido)methyl)-4-...)
Show SMILES CC[C@@H](Cc1ccc(OC)c(CNC(=O)c2ccc(Oc3ccc(F)cc3)cc2)c1)C(O)=O |r|
Show InChI InChI=1S/C26H26FNO5/c1-3-18(26(30)31)14-17-4-13-24(32-2)20(15-17)16-28-25(29)19-5-9-22(10-6-19)33-23-11-7-21(27)8-12-23/h4-13,15,18H,3,14,16H2,1-2H3,(H,28,29)(H,30,31)/t18-/m0/s1
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n/an/an/an/a 5n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-fussed PPARalpha expressed in human HEK293 cells by reporter gene assay


Bioorg Med Chem 19: 3183-91 (2011)


Article DOI: 10.1016/j.bmc.2011.03.064
BindingDB Entry DOI: 10.7270/Q2S75GNC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50344331
PNG
(CHEMBL270587 | rac-2-(3-{[(biphenyl-4-carbonyl)-am...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccc(cc2)-c2ccccc2)c1)C(O)=O |w:2.2|
Show InChI InChI=1S/C26H27NO4/c1-3-19(26(29)30)15-18-9-14-24(31-2)23(16-18)17-27-25(28)22-12-10-21(11-13-22)20-7-5-4-6-8-20/h4-14,16,19H,3,15,17H2,1-2H3,(H,27,28)(H,29,30)
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n/an/an/an/a 7.60n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-fussed PPARalpha expressed in human HEK293 cells by reporter gene assay


Bioorg Med Chem 19: 3183-91 (2011)


Article DOI: 10.1016/j.bmc.2011.03.064
BindingDB Entry DOI: 10.7270/Q2S75GNC
More data for this
Ligand-Target Pair