BindingDB logo
myBDB logout

22 similar compounds to monomer 50231514

Compile data set for download or QSAR
Wt: 409.3
BDBM50131739
Wt: 371.4
BDBM50131746
Wt: 445.5
BDBM50131753
Wt: 423.4
BDBM50214197
Wt: 437.4
BDBM50214201
Wt: 381.3
BDBM50214206
Wt: 395.3
BDBM50214210
Wt: 503.6
BDBM50231507
Wt: 475.6
BDBM50231513
Wt: 493.6
BDBM50273019
Wt: 493.6
BDBM50273020
Wt: 493.6
BDBM50273054
Wt: 491.0
BDBM50231511
Wt: 512.0
BDBM50231517
Wt: 311.3
BDBM50231516
Displayed 1 to 15 (of 22 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 62 hits for monomerid = 50131739,50131746,50131753,50214197,50214201,50214206,50214210,50231507,50231513,50273019,50273020,50273054,50231511,50231517,50231516   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Carbonic anhydrase 4


(Homo sapiens (Human))
BDBM50231516
PNG
(CHEMBL4104116)
Show SMILES COc1ccc(c(c1)-c1cc(NC(C)=O)on1)S(N)(=O)=O
Show InChI InChI=1S/C12H13N3O5S/c1-7(16)14-12-6-10(15-20-12)9-5-8(19-2)3-4-11(9)21(13,17)18/h3-6H,1-2H3,(H,14,16)(H2,13,17,18)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Saint Petersburg State University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human carbonic anhydrase-4 assessed as reduction in enzyme-catalyzed hydration activity using CO2 as substrate preincubated...


Bioorg Med Chem 25: 1914-1925 (2017)


Article DOI: 10.1016/j.bmc.2017.02.018
BindingDB Entry DOI: 10.7270/Q2ZP48CZ
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50231516
PNG
(CHEMBL4104116)
Show SMILES COc1ccc(c(c1)-c1cc(NC(C)=O)on1)S(N)(=O)=O
Show InChI InChI=1S/C12H13N3O5S/c1-7(16)14-12-6-10(15-20-12)9-5-8(19-2)3-4-11(9)21(13,17)18/h3-6H,1-2H3,(H,14,16)(H2,13,17,18)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Saint Petersburg State University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human carbonic anhydrase-2 assessed as reduction in enzyme-catalyzed hydration activity using CO2 as substrate preincubated...


Bioorg Med Chem 25: 1914-1925 (2017)


Article DOI: 10.1016/j.bmc.2017.02.018
BindingDB Entry DOI: 10.7270/Q2ZP48CZ
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50231516
PNG
(CHEMBL4104116)
Show SMILES COc1ccc(c(c1)-c1cc(NC(C)=O)on1)S(N)(=O)=O
Show InChI InChI=1S/C12H13N3O5S/c1-7(16)14-12-6-10(15-20-12)9-5-8(19-2)3-4-11(9)21(13,17)18/h3-6H,1-2H3,(H,14,16)(H2,13,17,18)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Saint Petersburg State University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human carbonic anhydrase-1 assessed as reduction in enzyme-catalyzed hydration activity using CO2 as substrate preincubated...


Bioorg Med Chem 25: 1914-1925 (2017)


Article DOI: 10.1016/j.bmc.2017.02.018
BindingDB Entry DOI: 10.7270/Q2ZP48CZ
More data for this
Ligand-Target Pair
Carbonic anhydrase 7


(Homo sapiens (Human))
BDBM50231516
PNG
(CHEMBL4104116)
Show SMILES COc1ccc(c(c1)-c1cc(NC(C)=O)on1)S(N)(=O)=O
Show InChI InChI=1S/C12H13N3O5S/c1-7(16)14-12-6-10(15-20-12)9-5-8(19-2)3-4-11(9)21(13,17)18/h3-6H,1-2H3,(H,14,16)(H2,13,17,18)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Saint Petersburg State University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human carbonic anhydrase-7 assessed as reduction in enzyme-catalyzed hydration activity using CO2 as substrate preincubated...


Bioorg Med Chem 25: 1914-1925 (2017)


Article DOI: 10.1016/j.bmc.2017.02.018
BindingDB Entry DOI: 10.7270/Q2ZP48CZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50131753
PNG
(2-[4-Methoxy-3-(4-phenethyl-benzylcarbamoyl)-benzy...)
Show SMILES CCC(Cc1ccc(OC)c(c1)C(=O)NCc1ccc(CCc2ccccc2)cc1)C(O)=O
Show InChI InChI=1S/C28H31NO4/c1-3-24(28(31)32)17-23-15-16-26(33-2)25(18-23)27(30)29-19-22-13-11-21(12-14-22)10-9-20-7-5-4-6-8-20/h4-8,11-16,18,24H,3,9-10,17,19H2,1-2H3,(H,29,30)(H,31,32)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 5.40E+3n/an/an/an/a



Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity on Gal4 chimeric human Peroxisome proliferator activated receptor gamma expressed in KRP-297 cells


J Med Chem 46: 3581-99 (2003)


Article DOI: 10.1021/jm0205144
BindingDB Entry DOI: 10.7270/Q2R78DMX
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50131739
PNG
((+/-)-2-(4-methoxy-3-((4-(trifluoromethyl)benzamid...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccc(cc2)C(F)(F)F)c1)C(O)=O
Show InChI InChI=1S/C21H22F3NO4/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)21(22,23)24/h4-9,11,14H,3,10,12H2,1-2H3,(H,25,26)(H,27,28)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/an/an/a 2.00E+3n/an/an/an/a



University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at PPARgamma transfected in HEK293 cells


Bioorg Med Chem Lett 16: 554-8 (2005)


Article DOI: 10.1016/j.bmcl.2005.10.049
BindingDB Entry DOI: 10.7270/Q2DF6QS3
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50131739
PNG
((+/-)-2-(4-methoxy-3-((4-(trifluoromethyl)benzamid...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccc(cc2)C(F)(F)F)c1)C(O)=O
Show InChI InChI=1S/C21H22F3NO4/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)21(22,23)24/h4-9,11,14H,3,10,12H2,1-2H3,(H,25,26)(H,27,28)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/an/an/a 130n/an/an/an/a



University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at PPARdelta transfected in HEK293 cells


Bioorg Med Chem Lett 16: 554-8 (2005)


Article DOI: 10.1016/j.bmcl.2005.10.049
BindingDB Entry DOI: 10.7270/Q2DF6QS3
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50131739
PNG
((+/-)-2-(4-methoxy-3-((4-(trifluoromethyl)benzamid...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccc(cc2)C(F)(F)F)c1)C(O)=O
Show InChI InChI=1S/C21H22F3NO4/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)21(22,23)24/h4-9,11,14H,3,10,12H2,1-2H3,(H,25,26)(H,27,28)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/an/an/a 10n/an/an/an/a



University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at PPARalpha transfected in HEK293 cells


Bioorg Med Chem Lett 16: 554-8 (2005)


Article DOI: 10.1016/j.bmcl.2005.10.049
BindingDB Entry DOI: 10.7270/Q2DF6QS3
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50214197
PNG
(2-{4-methoxy-3-[(4-trifluoromethylbenzoylamino)-me...)
Show SMILES CCCC(Cc1ccc(OC)c(CNC(=O)c2ccc(cc2)C(F)(F)F)c1)C(O)=O
Show InChI InChI=1S/C22H24F3NO4/c1-3-4-16(21(28)29)11-14-5-10-19(30-2)17(12-14)13-26-20(27)15-6-8-18(9-7-15)22(23,24)25/h5-10,12,16H,3-4,11,13H2,1-2H3,(H,26,27)(H,28,29)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 3.60E+3n/an/an/an/a



University of Tokyo

Curated by ChEMBL


Assay Description
Effect on PPARgamma transactivation activity in HEK293 cells


Bioorg Med Chem 15: 5177-90 (2007)


Article DOI: 10.1016/j.bmc.2007.05.023
BindingDB Entry DOI: 10.7270/Q2QZ29P7
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50214201
PNG
(2-{4-methoxy-3-[(4-trifluoromethylbenzoylamino)-me...)
Show SMILES CCCCC(Cc1ccc(OC)c(CNC(=O)c2ccc(cc2)C(F)(F)F)c1)C(O)=O
Show InChI InChI=1S/C23H26F3NO4/c1-3-4-5-17(22(29)30)12-15-6-11-20(31-2)18(13-15)14-27-21(28)16-7-9-19(10-8-16)23(24,25)26/h6-11,13,17H,3-5,12,14H2,1-2H3,(H,27,28)(H,29,30)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 2.40E+3n/an/an/an/a



University of Tokyo

Curated by ChEMBL


Assay Description
Effect on PPARgamma transactivation activity in HEK293 cells


Bioorg Med Chem 15: 5177-90 (2007)


Article DOI: 10.1016/j.bmc.2007.05.023
BindingDB Entry DOI: 10.7270/Q2QZ29P7
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50131739
PNG
((+/-)-2-(4-methoxy-3-((4-(trifluoromethyl)benzamid...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccc(cc2)C(F)(F)F)c1)C(O)=O
Show InChI InChI=1S/C21H22F3NO4/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)21(22,23)24/h4-9,11,14H,3,10,12H2,1-2H3,(H,25,26)(H,27,28)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/an/an/a 2.60E+3n/an/an/an/a



University of Tokyo

Curated by ChEMBL


Assay Description
Effect on PPARgamma transactivation activity in HEK293 cells


Bioorg Med Chem 15: 5177-90 (2007)


Article DOI: 10.1016/j.bmc.2007.05.023
BindingDB Entry DOI: 10.7270/Q2QZ29P7
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50214201
PNG
(2-{4-methoxy-3-[(4-trifluoromethylbenzoylamino)-me...)
Show SMILES CCCCC(Cc1ccc(OC)c(CNC(=O)c2ccc(cc2)C(F)(F)F)c1)C(O)=O
Show InChI InChI=1S/C23H26F3NO4/c1-3-4-5-17(22(29)30)12-15-6-11-20(31-2)18(13-15)14-27-21(28)16-7-9-19(10-8-16)23(24,25)26/h6-11,13,17H,3-5,12,14H2,1-2H3,(H,27,28)(H,29,30)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 230n/an/an/an/a



University of Tokyo

Curated by ChEMBL


Assay Description
Effect on PPARalpha transactivation activity in HEK293 cells


Bioorg Med Chem 15: 5177-90 (2007)


Article DOI: 10.1016/j.bmc.2007.05.023
BindingDB Entry DOI: 10.7270/Q2QZ29P7
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50214197
PNG
(2-{4-methoxy-3-[(4-trifluoromethylbenzoylamino)-me...)
Show SMILES CCCC(Cc1ccc(OC)c(CNC(=O)c2ccc(cc2)C(F)(F)F)c1)C(O)=O
Show InChI InChI=1S/C22H24F3NO4/c1-3-4-16(21(28)29)11-14-5-10-19(30-2)17(12-14)13-26-20(27)15-6-8-18(9-7-15)22(23,24)25/h5-10,12,16H,3-4,11,13H2,1-2H3,(H,26,27)(H,28,29)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 120n/an/an/an/a



University of Tokyo

Curated by ChEMBL


Assay Description
Effect on PPARdelta transactivation activity in HEK293 cells


Bioorg Med Chem 15: 5177-90 (2007)


Article DOI: 10.1016/j.bmc.2007.05.023
BindingDB Entry DOI: 10.7270/Q2QZ29P7
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50214201
PNG
(2-{4-methoxy-3-[(4-trifluoromethylbenzoylamino)-me...)
Show SMILES CCCCC(Cc1ccc(OC)c(CNC(=O)c2ccc(cc2)C(F)(F)F)c1)C(O)=O
Show InChI InChI=1S/C23H26F3NO4/c1-3-4-5-17(22(29)30)12-15-6-11-20(31-2)18(13-15)14-27-21(28)16-7-9-19(10-8-16)23(24,25)26/h6-11,13,17H,3-5,12,14H2,1-2H3,(H,27,28)(H,29,30)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 700n/an/an/an/a



University of Tokyo

Curated by ChEMBL


Assay Description
Effect on PPARdelta transactivation activity in HEK293 cells


Bioorg Med Chem 15: 5177-90 (2007)


Article DOI: 10.1016/j.bmc.2007.05.023
BindingDB Entry DOI: 10.7270/Q2QZ29P7
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50214206
PNG
(3-(4-methoxy-3-((4-(trifluoromethyl)benzamido)meth...)
Show SMILES COc1ccc(CCC(O)=O)cc1CNC(=O)c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C19H18F3NO4/c1-27-16-8-2-12(3-9-17(24)25)10-14(16)11-23-18(26)13-4-6-15(7-5-13)19(20,21)22/h2,4-8,10H,3,9,11H2,1H3,(H,23,26)(H,24,25)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a>1.00E+4n/an/an/an/a



University of Tokyo

Curated by ChEMBL


Assay Description
Effect on PPARgamma transactivation activity in HEK293 cells


Bioorg Med Chem 15: 5177-90 (2007)


Article DOI: 10.1016/j.bmc.2007.05.023
BindingDB Entry DOI: 10.7270/Q2QZ29P7
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50214210
PNG
(3-(4-methoxy-3-((4-(trifluoromethyl)benzamido)meth...)
Show SMILES COc1ccc(CC(C)C(O)=O)cc1CNC(=O)c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C20H20F3NO4/c1-12(19(26)27)9-13-3-8-17(28-2)15(10-13)11-24-18(25)14-4-6-16(7-5-14)20(21,22)23/h3-8,10,12H,9,11H2,1-2H3,(H,24,25)(H,26,27)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 19n/an/an/an/a



University of Tokyo

Curated by ChEMBL


Assay Description
Effect on PPARalpha transactivation activity in HEK293 cells


Bioorg Med Chem 15: 5177-90 (2007)


Article DOI: 10.1016/j.bmc.2007.05.023
BindingDB Entry DOI: 10.7270/Q2QZ29P7
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50214206
PNG
(3-(4-methoxy-3-((4-(trifluoromethyl)benzamido)meth...)
Show SMILES COc1ccc(CCC(O)=O)cc1CNC(=O)c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C19H18F3NO4/c1-27-16-8-2-12(3-9-17(24)25)10-14(16)11-23-18(26)13-4-6-15(7-5-13)19(20,21)22/h2,4-8,10H,3,9,11H2,1H3,(H,23,26)(H,24,25)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 210n/an/an/an/a



University of Tokyo

Curated by ChEMBL


Assay Description
Effect on PPARalpha transactivation activity in HEK293 cells


Bioorg Med Chem 15: 5177-90 (2007)


Article DOI: 10.1016/j.bmc.2007.05.023
BindingDB Entry DOI: 10.7270/Q2QZ29P7
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50131739
PNG
((+/-)-2-(4-methoxy-3-((4-(trifluoromethyl)benzamid...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccc(cc2)C(F)(F)F)c1)C(O)=O
Show InChI InChI=1S/C21H22F3NO4/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)21(22,23)24/h4-9,11,14H,3,10,12H2,1-2H3,(H,25,26)(H,27,28)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/an/an/a 18n/an/an/an/a



University of Tokyo

Curated by ChEMBL


Assay Description
Effect on PPARalpha transactivation activity in HEK293 cells


Bioorg Med Chem 15: 5177-90 (2007)


Article DOI: 10.1016/j.bmc.2007.05.023
BindingDB Entry DOI: 10.7270/Q2QZ29P7
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50214210
PNG
(3-(4-methoxy-3-((4-(trifluoromethyl)benzamido)meth...)
Show SMILES COc1ccc(CC(C)C(O)=O)cc1CNC(=O)c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C20H20F3NO4/c1-12(19(26)27)9-13-3-8-17(28-2)15(10-13)11-24-18(25)14-4-6-16(7-5-14)20(21,22)23/h3-8,10,12H,9,11H2,1-2H3,(H,24,25)(H,26,27)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 210n/an/an/an/a



University of Tokyo

Curated by ChEMBL


Assay Description
Effect on PPARdelta transactivation activity in HEK293 cells


Bioorg Med Chem 15: 5177-90 (2007)


Article DOI: 10.1016/j.bmc.2007.05.023
BindingDB Entry DOI: 10.7270/Q2QZ29P7
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50214210
PNG
(3-(4-methoxy-3-((4-(trifluoromethyl)benzamido)meth...)
Show SMILES COc1ccc(CC(C)C(O)=O)cc1CNC(=O)c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C20H20F3NO4/c1-12(19(26)27)9-13-3-8-17(28-2)15(10-13)11-24-18(25)14-4-6-16(7-5-14)20(21,22)23/h3-8,10,12H,9,11H2,1-2H3,(H,24,25)(H,26,27)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a>1.00E+4n/an/an/an/a



University of Tokyo

Curated by ChEMBL


Assay Description
Effect on PPARgamma transactivation activity in HEK293 cells


Bioorg Med Chem 15: 5177-90 (2007)


Article DOI: 10.1016/j.bmc.2007.05.023
BindingDB Entry DOI: 10.7270/Q2QZ29P7
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50214206
PNG
(3-(4-methoxy-3-((4-(trifluoromethyl)benzamido)meth...)
Show SMILES COc1ccc(CCC(O)=O)cc1CNC(=O)c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C19H18F3NO4/c1-27-16-8-2-12(3-9-17(24)25)10-14(16)11-23-18(26)13-4-6-15(7-5-13)19(20,21)22/h2,4-8,10H,3,9,11H2,1H3,(H,23,26)(H,24,25)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 3.00E+3n/an/an/an/a



University of Tokyo

Curated by ChEMBL


Assay Description
Effect on PPARdelta transactivation activity in HEK293 cells


Bioorg Med Chem 15: 5177-90 (2007)


Article DOI: 10.1016/j.bmc.2007.05.023
BindingDB Entry DOI: 10.7270/Q2QZ29P7
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50214197
PNG
(2-{4-methoxy-3-[(4-trifluoromethylbenzoylamino)-me...)
Show SMILES CCCC(Cc1ccc(OC)c(CNC(=O)c2ccc(cc2)C(F)(F)F)c1)C(O)=O
Show InChI InChI=1S/C22H24F3NO4/c1-3-4-16(21(28)29)11-14-5-10-19(30-2)17(12-14)13-26-20(27)15-6-8-18(9-7-15)22(23,24)25/h5-10,12,16H,3-4,11,13H2,1-2H3,(H,26,27)(H,28,29)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 70n/an/an/an/a



University of Tokyo

Curated by ChEMBL


Assay Description
Effect on PPARalpha transactivation activity in HEK293 cells


Bioorg Med Chem 15: 5177-90 (2007)


Article DOI: 10.1016/j.bmc.2007.05.023
BindingDB Entry DOI: 10.7270/Q2QZ29P7
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50131739
PNG
((+/-)-2-(4-methoxy-3-((4-(trifluoromethyl)benzamid...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccc(cc2)C(F)(F)F)c1)C(O)=O
Show InChI InChI=1S/C21H22F3NO4/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)21(22,23)24/h4-9,11,14H,3,10,12H2,1-2H3,(H,25,26)(H,27,28)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/an/an/a 170n/an/an/an/a



University of Tokyo

Curated by ChEMBL


Assay Description
Effect on PPARdelta transactivation activity in HEK293 cells


Bioorg Med Chem 15: 5177-90 (2007)


Article DOI: 10.1016/j.bmc.2007.05.023
BindingDB Entry DOI: 10.7270/Q2QZ29P7
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50131739
PNG
((+/-)-2-(4-methoxy-3-((4-(trifluoromethyl)benzamid...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccc(cc2)C(F)(F)F)c1)C(O)=O
Show InChI InChI=1S/C21H22F3NO4/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)21(22,23)24/h4-9,11,14H,3,10,12H2,1-2H3,(H,25,26)(H,27,28)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/an/an/a 10n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at PPARalpha (unknown origin) transfected in HEK293 cells by GAL4 transactivation assay


Bioorg Med Chem Lett 18: 4525-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.07.046
BindingDB Entry DOI: 10.7270/Q24X57KK
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50131739
PNG
((+/-)-2-(4-methoxy-3-((4-(trifluoromethyl)benzamid...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccc(cc2)C(F)(F)F)c1)C(O)=O
Show InChI InChI=1S/C21H22F3NO4/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)21(22,23)24/h4-9,11,14H,3,10,12H2,1-2H3,(H,25,26)(H,27,28)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/an/an/a 130n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at PPARdelta (unknown origin) transfected in HEK293 cells by GAL4 transactivation assay


Bioorg Med Chem Lett 18: 4525-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.07.046
BindingDB Entry DOI: 10.7270/Q24X57KK
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50131739
PNG
((+/-)-2-(4-methoxy-3-((4-(trifluoromethyl)benzamid...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccc(cc2)C(F)(F)F)c1)C(O)=O
Show InChI InChI=1S/C21H22F3NO4/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)21(22,23)24/h4-9,11,14H,3,10,12H2,1-2H3,(H,25,26)(H,27,28)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/an/an/a 2.60E+3n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at PPARgamma (unknown origin) transfected in HEK293 cells by GAL4 transactivation assay


Bioorg Med Chem Lett 18: 4525-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.07.046
BindingDB Entry DOI: 10.7270/Q24X57KK
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50231507
PNG
((2S)-2-(4-propoxy-3-{[({4-[(3S,5S,7S)-tricyclo[3.3...)
Show SMILES CCCOc1ccc(C[C@H](CC)C(O)=O)cc1CNC(=O)c1ccc(cc1)C12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C32H41NO4/c1-3-11-37-29-10-5-21(15-25(4-2)31(35)36)16-27(29)20-33-30(34)26-6-8-28(9-7-26)32-17-22-12-23(18-32)14-24(13-22)19-32/h5-10,16,22-25H,3-4,11-15,17-20H2,1-2H3,(H,33,34)(H,35,36)/t22?,23?,24?,25-,32?/m0/s1
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
CHEMBL
MMDB
PC cid
PC sid
PDB
UniChem

Similars

PDB
Article
PubMed
n/an/an/an/a 58n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at PPARalpha (unknown origin) transfected in HEK293 cells by GAL4 transactivation assay


Bioorg Med Chem Lett 18: 4525-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.07.046
BindingDB Entry DOI: 10.7270/Q24X57KK
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50273054
PNG
((+/-)-2-{5-[(4-Adamantan-1-yl-benzoylamino)-methyl...)
Show SMILES CCC(Cc1cc(CNC(=O)c2ccc(cc2)C23CC4CC(CC(C4)C2)C3)c(OC)cc1F)C(O)=O
Show InChI InChI=1S/C30H36FNO4/c1-3-21(29(34)35)11-23-12-24(27(36-2)13-26(23)31)17-32-28(33)22-4-6-25(7-5-22)30-14-18-8-19(15-30)10-20(9-18)16-30/h4-7,12-13,18-21H,3,8-11,14-17H2,1-2H3,(H,32,33)(H,34,35)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 13n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at PPARalpha (unknown origin) transfected in HEK293 cells by GAL4 transactivation assay


Bioorg Med Chem Lett 18: 4525-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.07.046
BindingDB Entry DOI: 10.7270/Q24X57KK
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50273020
PNG
((+/-)-2-{3-[(4-Adamantan-1-yl-benzoylamino)-methyl...)
Show SMILES CCC(Cc1cc(F)c(OC)c(CNC(=O)c2ccc(cc2)C23CC4CC(CC(C4)C2)C3)c1)C(O)=O
Show InChI InChI=1S/C30H36FNO4/c1-3-22(29(34)35)11-18-12-24(27(36-2)26(31)13-18)17-32-28(33)23-4-6-25(7-5-23)30-14-19-8-20(15-30)10-21(9-19)16-30/h4-7,12-13,19-22H,3,8-11,14-17H2,1-2H3,(H,32,33)(H,34,35)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 260n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at PPARalpha (unknown origin) transfected in HEK293 cells by GAL4 transactivation assay


Bioorg Med Chem Lett 18: 4525-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.07.046
BindingDB Entry DOI: 10.7270/Q24X57KK
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50273019
PNG
((+/-)-2-{3-[(4-Adamantan-1-yl-2-fluoro-benzoylamin...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccc(cc2F)C23CC4CC(CC(C4)C2)C3)c1)C(O)=O
Show InChI InChI=1S/C30H36FNO4/c1-3-22(29(34)35)11-18-4-7-27(36-2)23(12-18)17-32-28(33)25-6-5-24(13-26(25)31)30-14-19-8-20(15-30)10-21(9-19)16-30/h4-7,12-13,19-22H,3,8-11,14-17H2,1-2H3,(H,32,33)(H,34,35)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 60n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at PPARalpha (unknown origin) transfected in HEK293 cells by GAL4 transactivation assay


Bioorg Med Chem Lett 18: 4525-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.07.046
BindingDB Entry DOI: 10.7270/Q24X57KK
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50231513
PNG
((+/-)-2-{3-[(4-Adamantan-1-yl-benzoylamino)-methyl...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccc(cc2)C23CC4CC(CC(C4)C2)C3)c1)C(O)=O
Show InChI InChI=1S/C30H37NO4/c1-3-23(29(33)34)13-19-4-9-27(35-2)25(14-19)18-31-28(32)24-5-7-26(8-6-24)30-15-20-10-21(16-30)12-22(11-20)17-30/h4-9,14,20-23H,3,10-13,15-18H2,1-2H3,(H,31,32)(H,33,34)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 53n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at PPARalpha (unknown origin) transfected in HEK293 cells by GAL4 transactivation assay


Bioorg Med Chem Lett 18: 4525-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.07.046
BindingDB Entry DOI: 10.7270/Q24X57KK
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50231507
PNG
((2S)-2-(4-propoxy-3-{[({4-[(3S,5S,7S)-tricyclo[3.3...)
Show SMILES CCCOc1ccc(C[C@H](CC)C(O)=O)cc1CNC(=O)c1ccc(cc1)C12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C32H41NO4/c1-3-11-37-29-10-5-21(15-25(4-2)31(35)36)16-27(29)20-33-30(34)26-6-8-28(9-7-26)32-17-22-12-23(18-32)14-24(13-22)19-32/h5-10,16,22-25H,3-4,11-15,17-20H2,1-2H3,(H,33,34)(H,35,36)/t22?,23?,24?,25-,32?/m0/s1
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
CHEMBL
MMDB
PC cid
PC sid
PDB
UniChem

Similars

Article
PubMed
n/an/an/an/a 120n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at PPARdelta (unknown origin) transfected in HEK293 cells by GAL4 transactivation assay


Bioorg Med Chem Lett 18: 4525-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.07.046
BindingDB Entry DOI: 10.7270/Q24X57KK
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50273054
PNG
((+/-)-2-{5-[(4-Adamantan-1-yl-benzoylamino)-methyl...)
Show SMILES CCC(Cc1cc(CNC(=O)c2ccc(cc2)C23CC4CC(CC(C4)C2)C3)c(OC)cc1F)C(O)=O
Show InChI InChI=1S/C30H36FNO4/c1-3-21(29(34)35)11-23-12-24(27(36-2)13-26(23)31)17-32-28(33)22-4-6-25(7-5-22)30-14-18-8-19(15-30)10-20(9-18)16-30/h4-7,12-13,18-21H,3,8-11,14-17H2,1-2H3,(H,32,33)(H,34,35)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 280n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at PPARdelta (unknown origin) transfected in HEK293 cells by GAL4 transactivation assay


Bioorg Med Chem Lett 18: 4525-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.07.046
BindingDB Entry DOI: 10.7270/Q24X57KK
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50273020
PNG
((+/-)-2-{3-[(4-Adamantan-1-yl-benzoylamino)-methyl...)
Show SMILES CCC(Cc1cc(F)c(OC)c(CNC(=O)c2ccc(cc2)C23CC4CC(CC(C4)C2)C3)c1)C(O)=O
Show InChI InChI=1S/C30H36FNO4/c1-3-22(29(34)35)11-18-12-24(27(36-2)26(31)13-18)17-32-28(33)23-4-6-25(7-5-23)30-14-19-8-20(15-30)10-21(9-19)16-30/h4-7,12-13,19-22H,3,8-11,14-17H2,1-2H3,(H,32,33)(H,34,35)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 2.20E+3n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at PPARdelta (unknown origin) transfected in HEK293 cells by GAL4 transactivation assay


Bioorg Med Chem Lett 18: 4525-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.07.046
BindingDB Entry DOI: 10.7270/Q24X57KK
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50273019
PNG
((+/-)-2-{3-[(4-Adamantan-1-yl-2-fluoro-benzoylamin...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccc(cc2F)C23CC4CC(CC(C4)C2)C3)c1)C(O)=O
Show InChI InChI=1S/C30H36FNO4/c1-3-22(29(34)35)11-18-4-7-27(36-2)23(12-18)17-32-28(33)25-6-5-24(13-26(25)31)30-14-19-8-20(15-30)10-21(9-19)16-30/h4-7,12-13,19-22H,3,8-11,14-17H2,1-2H3,(H,32,33)(H,34,35)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 550n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at PPARdelta (unknown origin) transfected in HEK293 cells by GAL4 transactivation assay


Bioorg Med Chem Lett 18: 4525-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.07.046
BindingDB Entry DOI: 10.7270/Q24X57KK
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50231513
PNG
((+/-)-2-{3-[(4-Adamantan-1-yl-benzoylamino)-methyl...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccc(cc2)C23CC4CC(CC(C4)C2)C3)c1)C(O)=O
Show InChI InChI=1S/C30H37NO4/c1-3-23(29(33)34)13-19-4-9-27(35-2)25(14-19)18-31-28(32)24-5-7-26(8-6-24)30-15-20-10-21(16-30)12-22(11-20)17-30/h4-9,14,20-23H,3,10-13,15-18H2,1-2H3,(H,31,32)(H,33,34)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 940n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at PPARdelta (unknown origin) transfected in HEK293 cells by GAL4 transactivation assay


Bioorg Med Chem Lett 18: 4525-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.07.046
BindingDB Entry DOI: 10.7270/Q24X57KK
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50231507
PNG
((2S)-2-(4-propoxy-3-{[({4-[(3S,5S,7S)-tricyclo[3.3...)
Show SMILES CCCOc1ccc(C[C@H](CC)C(O)=O)cc1CNC(=O)c1ccc(cc1)C12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C32H41NO4/c1-3-11-37-29-10-5-21(15-25(4-2)31(35)36)16-27(29)20-33-30(34)26-6-8-28(9-7-26)32-17-22-12-23(18-32)14-24(13-22)19-32/h5-10,16,22-25H,3-4,11-15,17-20H2,1-2H3,(H,33,34)(H,35,36)/t22?,23?,24?,25-,32?/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
CHEMBL
MMDB
PC cid
PC sid
PDB
UniChem

Similars

PDB
Article
PubMed
n/an/an/an/a 43n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at PPARgamma (unknown origin) transfected in HEK293 cells by GAL4 transactivation assay


Bioorg Med Chem Lett 18: 4525-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.07.046
BindingDB Entry DOI: 10.7270/Q24X57KK
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50273054
PNG
((+/-)-2-{5-[(4-Adamantan-1-yl-benzoylamino)-methyl...)
Show SMILES CCC(Cc1cc(CNC(=O)c2ccc(cc2)C23CC4CC(CC(C4)C2)C3)c(OC)cc1F)C(O)=O
Show InChI InChI=1S/C30H36FNO4/c1-3-21(29(34)35)11-23-12-24(27(36-2)13-26(23)31)17-32-28(33)22-4-6-25(7-5-22)30-14-18-8-19(15-30)10-20(9-18)16-30/h4-7,12-13,18-21H,3,8-11,14-17H2,1-2H3,(H,32,33)(H,34,35)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 36n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at PPARgamma (unknown origin) transfected in HEK293 cells by GAL4 transactivation assay


Bioorg Med Chem Lett 18: 4525-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.07.046
BindingDB Entry DOI: 10.7270/Q24X57KK
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50273020
PNG
((+/-)-2-{3-[(4-Adamantan-1-yl-benzoylamino)-methyl...)
Show SMILES CCC(Cc1cc(F)c(OC)c(CNC(=O)c2ccc(cc2)C23CC4CC(CC(C4)C2)C3)c1)C(O)=O
Show InChI InChI=1S/C30H36FNO4/c1-3-22(29(34)35)11-18-12-24(27(36-2)26(31)13-18)17-32-28(33)23-4-6-25(7-5-23)30-14-19-8-20(15-30)10-21(9-19)16-30/h4-7,12-13,19-22H,3,8-11,14-17H2,1-2H3,(H,32,33)(H,34,35)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 190n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at PPARgamma (unknown origin) transfected in HEK293 cells by GAL4 transactivation assay


Bioorg Med Chem Lett 18: 4525-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.07.046
BindingDB Entry DOI: 10.7270/Q24X57KK
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50273019
PNG
((+/-)-2-{3-[(4-Adamantan-1-yl-2-fluoro-benzoylamin...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccc(cc2F)C23CC4CC(CC(C4)C2)C3)c1)C(O)=O
Show InChI InChI=1S/C30H36FNO4/c1-3-22(29(34)35)11-18-4-7-27(36-2)23(12-18)17-32-28(33)25-6-5-24(13-26(25)31)30-14-19-8-20(15-30)10-21(9-19)16-30/h4-7,12-13,19-22H,3,8-11,14-17H2,1-2H3,(H,32,33)(H,34,35)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 140n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at PPARgamma (unknown origin) transfected in HEK293 cells by GAL4 transactivation assay


Bioorg Med Chem Lett 18: 4525-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.07.046
BindingDB Entry DOI: 10.7270/Q24X57KK
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50231513
PNG
((+/-)-2-{3-[(4-Adamantan-1-yl-benzoylamino)-methyl...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccc(cc2)C23CC4CC(CC(C4)C2)C3)c1)C(O)=O
Show InChI InChI=1S/C30H37NO4/c1-3-23(29(33)34)13-19-4-9-27(35-2)25(14-19)18-31-28(32)24-5-7-26(8-6-24)30-15-20-10-21(16-30)12-22(11-20)17-30/h4-9,14,20-23H,3,10-13,15-18H2,1-2H3,(H,31,32)(H,33,34)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 110n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at PPARgamma (unknown origin) transfected in HEK293 cells by GAL4 transactivation assay


Bioorg Med Chem Lett 18: 4525-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.07.046
BindingDB Entry DOI: 10.7270/Q24X57KK
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50231507
PNG
((2S)-2-(4-propoxy-3-{[({4-[(3S,5S,7S)-tricyclo[3.3...)
Show SMILES CCCOc1ccc(C[C@H](CC)C(O)=O)cc1CNC(=O)c1ccc(cc1)C12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C32H41NO4/c1-3-11-37-29-10-5-21(15-25(4-2)31(35)36)16-27(29)20-33-30(34)26-6-8-28(9-7-26)32-17-22-12-23(18-32)14-24(13-22)19-32/h5-10,16,22-25H,3-4,11-15,17-20H2,1-2H3,(H,33,34)(H,35,36)/t22?,23?,24?,25-,32?/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
CHEMBL
MMDB
PC cid
PC sid
PDB
UniChem

Similars

PDB
Article
PubMed
n/an/an/an/a 41n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Transactivation of human PPARgamma expressed in human HEK293 cells after 16 to 20 hrs by dual luciferase beta-galactosidase reporter gene assay


Bioorg Med Chem 20: 6375-83 (2012)


Article DOI: 10.1016/j.bmc.2012.08.061
BindingDB Entry DOI: 10.7270/Q2F190VM
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50231507
PNG
((2S)-2-(4-propoxy-3-{[({4-[(3S,5S,7S)-tricyclo[3.3...)
Show SMILES CCCOc1ccc(C[C@H](CC)C(O)=O)cc1CNC(=O)c1ccc(cc1)C12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C32H41NO4/c1-3-11-37-29-10-5-21(15-25(4-2)31(35)36)16-27(29)20-33-30(34)26-6-8-28(9-7-26)32-17-22-12-23(18-32)14-24(13-22)19-32/h5-10,16,22-25H,3-4,11-15,17-20H2,1-2H3,(H,33,34)(H,35,36)/t22?,23?,24?,25-,32?/m0/s1
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
CHEMBL
MMDB
PC cid
PC sid
PDB
UniChem

Similars

Article
PubMed
n/an/an/an/a 130n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Transactivation of human PPARdelta expressed in human HEK293 cells after 16 to 20 hrs by dual luciferase beta-galactosidase reporter gene assay


Bioorg Med Chem 20: 6375-83 (2012)


Article DOI: 10.1016/j.bmc.2012.08.061
BindingDB Entry DOI: 10.7270/Q2F190VM
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50231507
PNG
((2S)-2-(4-propoxy-3-{[({4-[(3S,5S,7S)-tricyclo[3.3...)
Show SMILES CCCOc1ccc(C[C@H](CC)C(O)=O)cc1CNC(=O)c1ccc(cc1)C12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C32H41NO4/c1-3-11-37-29-10-5-21(15-25(4-2)31(35)36)16-27(29)20-33-30(34)26-6-8-28(9-7-26)32-17-22-12-23(18-32)14-24(13-22)19-32/h5-10,16,22-25H,3-4,11-15,17-20H2,1-2H3,(H,33,34)(H,35,36)/t22?,23?,24?,25-,32?/m0/s1
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
CHEMBL
MMDB
PC cid
PC sid
PDB
UniChem

Similars

PDB
Article
PubMed
n/an/an/an/a 54n/an/an/an/a



Okayama University

Curated by ChEMBL


Assay Description
Transactivation of human PPARalpha expressed in human HEK293 cells after 16 to 20 hrs by dual luciferase beta-galactosidase reporter gene assay


Bioorg Med Chem 20: 6375-83 (2012)


Article DOI: 10.1016/j.bmc.2012.08.061
BindingDB Entry DOI: 10.7270/Q2F190VM
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50231507
PNG
((2S)-2-(4-propoxy-3-{[({4-[(3S,5S,7S)-tricyclo[3.3...)
Show SMILES CCCOc1ccc(C[C@H](CC)C(O)=O)cc1CNC(=O)c1ccc(cc1)C12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C32H41NO4/c1-3-11-37-29-10-5-21(15-25(4-2)31(35)36)16-27(29)20-33-30(34)26-6-8-28(9-7-26)32-17-22-12-23(18-32)14-24(13-22)19-32/h5-10,16,22-25H,3-4,11-15,17-20H2,1-2H3,(H,33,34)(H,35,36)/t22?,23?,24?,25-,32?/m0/s1
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
CHEMBL
MMDB
PC cid
PC sid
PDB
UniChem

Similars

PDB
Article
PubMed
n/an/an/an/a 61n/an/an/an/a



University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant PPARalpha in HEK293 cells by GAL4 transactivation assay


Bioorg Med Chem Lett 18: 1110-5 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.001
BindingDB Entry DOI: 10.7270/Q2FX7B9S
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50231507
PNG
((2S)-2-(4-propoxy-3-{[({4-[(3S,5S,7S)-tricyclo[3.3...)
Show SMILES CCCOc1ccc(C[C@H](CC)C(O)=O)cc1CNC(=O)c1ccc(cc1)C12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C32H41NO4/c1-3-11-37-29-10-5-21(15-25(4-2)31(35)36)16-27(29)20-33-30(34)26-6-8-28(9-7-26)32-17-22-12-23(18-32)14-24(13-22)19-32/h5-10,16,22-25H,3-4,11-15,17-20H2,1-2H3,(H,33,34)(H,35,36)/t22?,23?,24?,25-,32?/m0/s1
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
CHEMBL
MMDB
PC cid
PC sid
PDB
UniChem

Similars

PDB
Article
PubMed
n/an/an/an/a 140n/an/an/an/a



University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant PPARalpha in HEK293 cells by GAL4 transactivation assay


Bioorg Med Chem Lett 18: 1110-5 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.001
BindingDB Entry DOI: 10.7270/Q2FX7B9S
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50231513
PNG
((+/-)-2-{3-[(4-Adamantan-1-yl-benzoylamino)-methyl...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccc(cc2)C23CC4CC(CC(C4)C2)C3)c1)C(O)=O
Show InChI InChI=1S/C30H37NO4/c1-3-23(29(33)34)13-19-4-9-27(35-2)25(14-19)18-31-28(32)24-5-7-26(8-6-24)30-15-20-10-21(16-30)12-22(11-20)17-30/h4-9,14,20-23H,3,10-13,15-18H2,1-2H3,(H,31,32)(H,33,34)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 95n/an/an/an/a



University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant PPARalpha in HEK293 cells by GAL4 transactivation assay


Bioorg Med Chem Lett 18: 1110-5 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.001
BindingDB Entry DOI: 10.7270/Q2FX7B9S
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50231507
PNG
((2S)-2-(4-propoxy-3-{[({4-[(3S,5S,7S)-tricyclo[3.3...)
Show SMILES CCCOc1ccc(C[C@H](CC)C(O)=O)cc1CNC(=O)c1ccc(cc1)C12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C32H41NO4/c1-3-11-37-29-10-5-21(15-25(4-2)31(35)36)16-27(29)20-33-30(34)26-6-8-28(9-7-26)32-17-22-12-23(18-32)14-24(13-22)19-32/h5-10,16,22-25H,3-4,11-15,17-20H2,1-2H3,(H,33,34)(H,35,36)/t22?,23?,24?,25-,32?/m0/s1
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
CHEMBL
MMDB
PC cid
PC sid
PDB
UniChem

Similars

Article
PubMed
n/an/an/an/a 120n/an/an/an/a



University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant PPARdelta in HEK293 cells by GAL4 transactivation assay


Bioorg Med Chem Lett 18: 1110-5 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.001
BindingDB Entry DOI: 10.7270/Q2FX7B9S
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50231507
PNG
((2S)-2-(4-propoxy-3-{[({4-[(3S,5S,7S)-tricyclo[3.3...)
Show SMILES CCCOc1ccc(C[C@H](CC)C(O)=O)cc1CNC(=O)c1ccc(cc1)C12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C32H41NO4/c1-3-11-37-29-10-5-21(15-25(4-2)31(35)36)16-27(29)20-33-30(34)26-6-8-28(9-7-26)32-17-22-12-23(18-32)14-24(13-22)19-32/h5-10,16,22-25H,3-4,11-15,17-20H2,1-2H3,(H,33,34)(H,35,36)/t22?,23?,24?,25-,32?/m0/s1
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
CHEMBL
MMDB
PC cid
PC sid
PDB
UniChem

Similars

Article
PubMed
n/an/an/an/a 220n/an/an/an/a



University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant PPARdelta in HEK293 cells by GAL4 transactivation assay


Bioorg Med Chem Lett 18: 1110-5 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.001
BindingDB Entry DOI: 10.7270/Q2FX7B9S
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50231513
PNG
((+/-)-2-{3-[(4-Adamantan-1-yl-benzoylamino)-methyl...)
Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccc(cc2)C23CC4CC(CC(C4)C2)C3)c1)C(O)=O
Show InChI InChI=1S/C30H37NO4/c1-3-23(29(33)34)13-19-4-9-27(35-2)25(14-19)18-31-28(32)24-5-7-26(8-6-24)30-15-20-10-21(16-30)12-22(11-20)17-30/h4-9,14,20-23H,3,10-13,15-18H2,1-2H3,(H,31,32)(H,33,34)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 1.10E+3n/an/an/an/a



University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant PPARdelta in HEK293 cells by GAL4 transactivation assay


Bioorg Med Chem Lett 18: 1110-5 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.001
BindingDB Entry DOI: 10.7270/Q2FX7B9S
More data for this
Ligand-Target Pair
Displayed 1 to 50 (of 62 total )  |  Next  |  Last  >>