Found 57 hits of Enzyme Inhibition Constant Data Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50214199
(2-{4-n-butoxy-3-[(2-fluoro-4-trifluoromethylbenzoy...)Show SMILES CCCCC(Cc1ccc(OC)c(CNC(=O)c2ccc(cc2F)C(F)(F)F)c1)C(O)=O |w:4.4| Show InChI InChI=1S/C23H25F4NO4/c1-3-4-5-15(22(30)31)10-14-6-9-20(32-2)16(11-14)13-28-21(29)18-8-7-17(12-19(18)24)23(25,26)27/h6-9,11-12,15H,3-5,10,13H2,1-2H3,(H,28,29)(H,30,31) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/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
(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
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 3.00E+3 | n/a | n/a | n/a | n/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
(Homo sapiens (Human)) | BDBM50214207
((2S)-2-{4-butoxy-3-[({[2-fluoro-4-(trifluoromethyl...)Show SMILES CCCCOc1ccc(C[C@H](CC)C(O)=O)cc1CNC(=O)c1ccc(cc1F)C(F)(F)F Show InChI InChI=1S/C24H27F4NO4/c1-3-5-10-33-21-9-6-15(11-16(4-2)23(31)32)12-17(21)14-29-22(30)19-8-7-18(13-20(19)25)24(26,27)28/h6-9,12-13,16H,3-5,10-11,14H2,1-2H3,(H,29,30)(H,31,32)/t16-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
MMDB
PC cid
PC sid
PDB
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 250 | n/a | n/a | n/a | n/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
(Homo sapiens (Human)) | BDBM50214211
(2-{4-n-propoxy-3-[(4-trifluoromethylbenzoylamino)m...)Show SMILES CCCOc1ccc(CC(CC)C(O)=O)cc1CNC(=O)c1ccc(cc1)C(F)(F)F |w:9.8| Show InChI InChI=1S/C23H26F3NO4/c1-3-11-31-20-10-5-15(12-16(4-2)22(29)30)13-18(20)14-27-21(28)17-6-8-19(9-7-17)23(24,25)26/h5-10,13,16H,3-4,11-12,14H2,1-2H3,(H,27,28)(H,29,30) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 77 | n/a | n/a | n/a | n/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
(Homo sapiens (Human)) | BDBM28661
(2-{2-methyl-4-[({4-methyl-2-[4-(trifluoromethyl)ph...)Show SMILES Cc1nc(sc1CSc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C21H18F3NO3S2/c1-12-9-16(7-8-17(12)28-10-19(26)27)29-11-18-13(2)25-20(30-18)14-3-5-15(6-4-14)21(22,23)24/h3-9H,10-11H2,1-2H3,(H,26,27) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
DrugBank
MCE
PC cid
PC sid
PDB
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/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 gamma
(Homo sapiens (Human)) | BDBM50214205
(2-(4-butoxy-3-((2-fluoro-4-(trifluoromethyl)benzam...)Show SMILES CCCCOc1ccc(CC(CC)C(O)=O)cc1CNC(=O)c1ccc(cc1F)C(F)(F)F |w:10.9| Show InChI InChI=1S/C24H27F4NO4/c1-3-5-10-33-21-9-6-15(11-16(4-2)23(31)32)12-17(21)14-29-22(30)19-8-7-18(13-20(19)25)24(26,27)28/h6-9,12-13,16H,3-5,10-11,14H2,1-2H3,(H,29,30)(H,31,32) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.40E+3 | n/a | n/a | n/a | n/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 gamma
(Homo sapiens (Human)) | BDBM50214210
(3-(4-methoxy-3-((4-(trifluoromethyl)benzamido)meth...)Show SMILES COc1ccc(CC(C)C(O)=O)cc1CNC(=O)c1ccc(cc1)C(F)(F)F |w:7.7| 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
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/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 gamma
(Homo sapiens (Human)) | BDBM50214209
((R)-2-(4-butoxy-3-((2-fluoro-4-(trifluoromethyl)be...)Show SMILES CCCCOc1ccc(C[C@@H](CC)C(O)=O)cc1CNC(=O)c1ccc(cc1F)C(F)(F)F Show InChI InChI=1S/C24H27F4NO4/c1-3-5-10-33-21-9-6-15(11-16(4-2)23(31)32)12-17(21)14-29-22(30)19-8-7-18(13-20(19)25)24(26,27)28/h6-9,12-13,16H,3-5,10-11,14H2,1-2H3,(H,29,30)(H,31,32)/t16-/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 7.00E+3 | n/a | n/a | n/a | n/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
(Homo sapiens (Human)) | BDBM50214198
(2-{4-n-hexyloxy-3-[(4-trifluoromethylbenzoylamino)...)Show SMILES CCCCCCOc1ccc(CC(CC)C(O)=O)cc1CNC(=O)c1ccc(cc1)C(F)(F)F |w:12.11| Show InChI InChI=1S/C26H32F3NO4/c1-3-5-6-7-14-34-23-13-8-18(15-19(4-2)25(32)33)16-21(23)17-30-24(31)20-9-11-22(12-10-20)26(27,28)29/h8-13,16,19H,3-7,14-15,17H2,1-2H3,(H,30,31)(H,32,33) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.20E+3 | n/a | n/a | n/a | n/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)) | BDBM50214211
(2-{4-n-propoxy-3-[(4-trifluoromethylbenzoylamino)m...)Show SMILES CCCOc1ccc(CC(CC)C(O)=O)cc1CNC(=O)c1ccc(cc1)C(F)(F)F |w:9.8| Show InChI InChI=1S/C23H26F3NO4/c1-3-11-31-20-10-5-15(12-16(4-2)22(29)30)13-18(20)14-27-21(28)17-6-8-19(9-7-17)23(24,25)26/h5-10,13,16H,3-4,11-12,14H2,1-2H3,(H,27,28)(H,29,30) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 6.80 | n/a | n/a | n/a | n/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 gamma
(Homo sapiens (Human)) | BDBM50214211
(2-{4-n-propoxy-3-[(4-trifluoromethylbenzoylamino)m...)Show SMILES CCCOc1ccc(CC(CC)C(O)=O)cc1CNC(=O)c1ccc(cc1)C(F)(F)F |w:9.8| Show InChI InChI=1S/C23H26F3NO4/c1-3-11-31-20-10-5-15(12-16(4-2)22(29)30)13-18(20)14-27-21(28)17-6-8-19(9-7-17)23(24,25)26/h5-10,13,16H,3-4,11-12,14H2,1-2H3,(H,27,28)(H,29,30) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.30E+3 | n/a | n/a | n/a | n/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)) | BDBM50214197
(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 |w:3.3| 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
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 120 | n/a | n/a | n/a | n/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)) | BDBM50214210
(3-(4-methoxy-3-((4-(trifluoromethyl)benzamido)meth...)Show SMILES COc1ccc(CC(C)C(O)=O)cc1CNC(=O)c1ccc(cc1)C(F)(F)F |w:7.7| 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
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 210 | n/a | n/a | n/a | n/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)) | BDBM50214209
((R)-2-(4-butoxy-3-((2-fluoro-4-(trifluoromethyl)be...)Show SMILES CCCCOc1ccc(C[C@@H](CC)C(O)=O)cc1CNC(=O)c1ccc(cc1F)C(F)(F)F Show InChI InChI=1S/C24H27F4NO4/c1-3-5-10-33-21-9-6-15(11-16(4-2)23(31)32)12-17(21)14-29-22(30)19-8-7-18(13-20(19)25)24(26,27)28/h6-9,12-13,16H,3-5,10-11,14H2,1-2H3,(H,29,30)(H,31,32)/t16-/m1/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 8.30 | n/a | n/a | n/a | n/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
(Homo sapiens (Human)) | BDBM50214197
(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 |w:3.3| 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
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 70 | n/a | n/a | n/a | n/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)) | BDBM50214204
(2-{4-methoxy-3-[(2-fluoro-4-trifluoromethylbenzoyl...)Show SMILES CCCC(Cc1ccc(OC)c(CNC(=O)c2ccc(cc2F)C(F)(F)F)c1)C(O)=O |w:3.3| Show InChI InChI=1S/C22H23F4NO4/c1-3-4-14(21(29)30)9-13-5-8-19(31-2)15(10-13)12-27-20(28)17-7-6-16(11-18(17)23)22(24,25)26/h5-8,10-11,14H,3-4,9,12H2,1-2H3,(H,27,28)(H,29,30) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 40 | n/a | n/a | n/a | n/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
(Homo sapiens (Human)) | BDBM50214204
(2-{4-methoxy-3-[(2-fluoro-4-trifluoromethylbenzoyl...)Show SMILES CCCC(Cc1ccc(OC)c(CNC(=O)c2ccc(cc2F)C(F)(F)F)c1)C(O)=O |w:3.3| Show InChI InChI=1S/C22H23F4NO4/c1-3-4-14(21(29)30)9-13-5-8-19(31-2)15(10-13)12-27-20(28)17-7-6-16(11-18(17)23)22(24,25)26/h5-8,10-11,14H,3-4,9,12H2,1-2H3,(H,27,28)(H,29,30) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 29 | n/a | n/a | n/a | n/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 gamma
(Homo sapiens (Human)) | BDBM50214203
((+/-)-2-(3-((2-fluoro-4-(trifluoromethyl)benzamido...)Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccc(cc2F)C(F)(F)F)c1)C(O)=O Show InChI InChI=1S/C21H21F4NO4/c1-3-13(20(28)29)8-12-4-7-18(30-2)14(9-12)11-26-19(27)16-6-5-15(10-17(16)22)21(23,24)25/h4-7,9-10,13H,3,8,11H2,1-2H3,(H,26,27)(H,28,29) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
PDB
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 2.20E+3 | n/a | n/a | n/a | n/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)) | BDBM50214207
((2S)-2-{4-butoxy-3-[({[2-fluoro-4-(trifluoromethyl...)Show SMILES CCCCOc1ccc(C[C@H](CC)C(O)=O)cc1CNC(=O)c1ccc(cc1F)C(F)(F)F Show InChI InChI=1S/C24H27F4NO4/c1-3-5-10-33-21-9-6-15(11-16(4-2)23(31)32)12-17(21)14-29-22(30)19-8-7-18(13-20(19)25)24(26,27)28/h6-9,12-13,16H,3-5,10-11,14H2,1-2H3,(H,29,30)(H,31,32)/t16-/m0/s1 | PDB
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| PDB
Article
PubMed
| n/a | n/a | n/a | n/a | 0.910 | n/a | n/a | n/a | n/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 | 
3D Structure (crystal) |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50214205
(2-(4-butoxy-3-((2-fluoro-4-(trifluoromethyl)benzam...)Show SMILES CCCCOc1ccc(CC(CC)C(O)=O)cc1CNC(=O)c1ccc(cc1F)C(F)(F)F |w:10.9| Show InChI InChI=1S/C24H27F4NO4/c1-3-5-10-33-21-9-6-15(11-16(4-2)23(31)32)12-17(21)14-29-22(30)19-8-7-18(13-20(19)25)24(26,27)28/h6-9,12-13,16H,3-5,10-11,14H2,1-2H3,(H,29,30)(H,31,32) | PDB
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| n/a | n/a | n/a | n/a | 1.90 | n/a | n/a | n/a | n/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
(Homo sapiens (Human)) | BDBM50214206
(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
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| n/a | n/a | n/a | n/a | 210 | n/a | n/a | n/a | n/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
(Homo sapiens (Human)) | BDBM50214196
(2-{4-benzyloxy-3-[(4-trifluoromethylbenzoylamino)m...)Show SMILES CCC(Cc1ccc(OCc2ccccc2)c(CNC(=O)c2ccc(cc2)C(F)(F)F)c1)C(O)=O |w:2.2| Show InChI InChI=1S/C27H26F3NO4/c1-2-20(26(33)34)14-19-8-13-24(35-17-18-6-4-3-5-7-18)22(15-19)16-31-25(32)21-9-11-23(12-10-21)27(28,29)30/h3-13,15,20H,2,14,16-17H2,1H3,(H,31,32)(H,33,34) | PDB
UniProtKB/SwissProt
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| n/a | n/a | n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/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
(Homo sapiens (Human)) | BDBM50131739
((+/-)-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
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| n/a | n/a | n/a | n/a | 18 | n/a | n/a | n/a | n/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
(Homo sapiens (Human)) | BDBM50214202
(2-{4-n-butoxy-3-[(4-trifluoromethylbenzoylamino)me...)Show SMILES CCCCOc1ccc(CC(CC)C(O)=O)cc1CNC(=O)c1ccc(cc1)C(F)(F)F |w:10.9| Show InChI InChI=1S/C24H28F3NO4/c1-3-5-12-32-21-11-6-16(13-17(4-2)23(30)31)14-19(21)15-28-22(29)18-7-9-20(10-8-18)24(25,26)27/h6-11,14,17H,3-5,12-13,15H2,1-2H3,(H,28,29)(H,30,31) | PDB
UniProtKB/SwissProt
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| n/a | n/a | n/a | n/a | 520 | n/a | n/a | n/a | n/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)) | BDBM50214200
(2-(4-butoxy-3-((2-fluoro-4-(trifluoromethyl)benzam...)Show SMILES CCCCOc1ccc(CC(CCC)C(O)=O)cc1CNC(=O)c1ccc(cc1F)C(F)(F)F |w:10.9| Show InChI InChI=1S/C25H29F4NO4/c1-3-5-11-34-22-10-7-16(12-17(6-4-2)24(32)33)13-18(22)15-30-23(31)20-9-8-19(14-21(20)26)25(27,28)29/h7-10,13-14,17H,3-6,11-12,15H2,1-2H3,(H,30,31)(H,32,33) | PDB
UniProtKB/SwissProt
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PubMed
| n/a | n/a | n/a | n/a | 5.10 | n/a | n/a | n/a | n/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)) | BDBM50214195
(2-{3-[(2-fluoro-4-trifluoromethylbenzoylamino)-met...)Show SMILES CCCOc1ccc(CC(CC)C(O)=O)cc1CNC(=O)c1ccc(cc1F)C(F)(F)F |w:9.8| Show InChI InChI=1S/C23H25F4NO4/c1-3-9-32-20-8-5-14(10-15(4-2)22(30)31)11-16(20)13-28-21(29)18-7-6-17(12-19(18)24)23(25,26)27/h5-8,11-12,15H,3-4,9-10,13H2,1-2H3,(H,28,29)(H,30,31) | PDB
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PubMed
| n/a | n/a | n/a | n/a | 1.70 | n/a | n/a | n/a | n/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
(Homo sapiens (Human)) | BDBM50214203
((+/-)-2-(3-((2-fluoro-4-(trifluoromethyl)benzamido...)Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccc(cc2F)C(F)(F)F)c1)C(O)=O Show InChI InChI=1S/C21H21F4NO4/c1-3-13(20(28)29)8-12-4-7-18(30-2)14(9-12)11-26-19(27)16-6-5-15(10-17(16)22)21(23,24)25/h4-7,9-10,13H,3,8,11H2,1-2H3,(H,26,27)(H,28,29) | PDB
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| n/a | n/a | n/a | n/a | 8.20 | n/a | n/a | n/a | n/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 gamma
(Homo sapiens (Human)) | BDBM50214208
(2-{4-ethoxy-3-[(4-trifluoromethylbenzoylamino)-met...)Show SMILES CCOc1ccc(CC(CC)C(O)=O)cc1CNC(=O)c1ccc(cc1)C(F)(F)F |w:8.7| Show InChI InChI=1S/C22H24F3NO4/c1-3-15(21(28)29)11-14-5-10-19(30-4-2)17(12-14)13-26-20(27)16-6-8-18(9-7-16)22(23,24)25/h5-10,12,15H,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
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| CHEMBL
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PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.80E+3 | n/a | n/a | n/a | n/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)) | BDBM50214199
(2-{4-n-butoxy-3-[(2-fluoro-4-trifluoromethylbenzoy...)Show SMILES CCCCC(Cc1ccc(OC)c(CNC(=O)c2ccc(cc2F)C(F)(F)F)c1)C(O)=O |w:4.4| Show InChI InChI=1S/C23H25F4NO4/c1-3-4-5-15(22(30)31)10-14-6-9-20(32-2)16(11-14)13-28-21(29)18-8-7-17(12-19(18)24)23(25,26)27/h6-9,11-12,15H,3-5,10,13H2,1-2H3,(H,28,29)(H,30,31) | PDB
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PubMed
| n/a | n/a | n/a | n/a | 220 | n/a | n/a | n/a | n/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 gamma
(Homo sapiens (Human)) | BDBM50214204
(2-{4-methoxy-3-[(2-fluoro-4-trifluoromethylbenzoyl...)Show SMILES CCCC(Cc1ccc(OC)c(CNC(=O)c2ccc(cc2F)C(F)(F)F)c1)C(O)=O |w:3.3| Show InChI InChI=1S/C22H23F4NO4/c1-3-4-14(21(29)30)9-13-5-8-19(31-2)15(10-13)12-27-20(28)17-7-6-16(11-18(17)23)22(24,25)26/h5-8,10-11,14H,3-4,9,12H2,1-2H3,(H,27,28)(H,29,30) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.50E+3 | n/a | n/a | n/a | n/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)) | BDBM50214198
(2-{4-n-hexyloxy-3-[(4-trifluoromethylbenzoylamino)...)Show SMILES CCCCCCOc1ccc(CC(CC)C(O)=O)cc1CNC(=O)c1ccc(cc1)C(F)(F)F |w:12.11| Show InChI InChI=1S/C26H32F3NO4/c1-3-5-6-7-14-34-23-13-8-18(15-19(4-2)25(32)33)16-21(23)17-30-24(31)20-9-11-22(12-10-20)26(27,28)29/h8-13,16,19H,3-7,14-15,17H2,1-2H3,(H,30,31)(H,32,33) | PDB
UniProtKB/SwissProt
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PC sid
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Similars
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PubMed
| n/a | n/a | n/a | n/a | 45 | n/a | n/a | n/a | n/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
(Homo sapiens (Human)) | BDBM50214210
(3-(4-methoxy-3-((4-(trifluoromethyl)benzamido)meth...)Show SMILES COc1ccc(CC(C)C(O)=O)cc1CNC(=O)c1ccc(cc1)C(F)(F)F |w:7.7| 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
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Similars
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PubMed
| n/a | n/a | n/a | n/a | 19 | n/a | n/a | n/a | n/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
(Homo sapiens (Human)) | BDBM50214200
(2-(4-butoxy-3-((2-fluoro-4-(trifluoromethyl)benzam...)Show SMILES CCCCOc1ccc(CC(CCC)C(O)=O)cc1CNC(=O)c1ccc(cc1F)C(F)(F)F |w:10.9| Show InChI InChI=1S/C25H29F4NO4/c1-3-5-11-34-22-10-7-16(12-17(6-4-2)24(32)33)13-18(22)15-30-23(31)20-9-8-19(14-21(20)26)25(27,28)29/h7-10,13-14,17H,3-6,11-12,15H2,1-2H3,(H,30,31)(H,32,33) | PDB
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PC sid
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Similars
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PubMed
| n/a | n/a | n/a | n/a | 820 | n/a | n/a | n/a | n/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 gamma
(Homo sapiens (Human)) | BDBM50214198
(2-{4-n-hexyloxy-3-[(4-trifluoromethylbenzoylamino)...)Show SMILES CCCCCCOc1ccc(CC(CC)C(O)=O)cc1CNC(=O)c1ccc(cc1)C(F)(F)F |w:12.11| Show InChI InChI=1S/C26H32F3NO4/c1-3-5-6-7-14-34-23-13-8-18(15-19(4-2)25(32)33)16-21(23)17-30-24(31)20-9-11-22(12-10-20)26(27,28)29/h8-13,16,19H,3-7,14-15,17H2,1-2H3,(H,30,31)(H,32,33) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 2.30E+3 | n/a | n/a | n/a | n/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 gamma
(Homo sapiens (Human)) | BDBM50214196
(2-{4-benzyloxy-3-[(4-trifluoromethylbenzoylamino)m...)Show SMILES CCC(Cc1ccc(OCc2ccccc2)c(CNC(=O)c2ccc(cc2)C(F)(F)F)c1)C(O)=O |w:2.2| Show InChI InChI=1S/C27H26F3NO4/c1-2-20(26(33)34)14-19-8-13-24(35-17-18-6-4-3-5-7-18)22(15-19)16-31-25(32)21-9-11-23(12-10-21)27(28,29)30/h3-13,15,20H,2,14,16-17H2,1H3,(H,31,32)(H,33,34) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 6.20E+3 | n/a | n/a | n/a | n/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)) | BDBM50214201
(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 |w:4.4| 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
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 700 | n/a | n/a | n/a | n/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)) | BDBM50214203
((+/-)-2-(3-((2-fluoro-4-(trifluoromethyl)benzamido...)Show SMILES CCC(Cc1ccc(OC)c(CNC(=O)c2ccc(cc2F)C(F)(F)F)c1)C(O)=O Show InChI InChI=1S/C21H21F4NO4/c1-3-13(20(28)29)8-12-4-7-18(30-2)14(9-12)11-26-19(27)16-6-5-15(10-17(16)22)21(23,24)25/h4-7,9-10,13H,3,8,11H2,1-2H3,(H,26,27)(H,28,29) | PDB
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Article
PubMed
| n/a | n/a | n/a | n/a | 21 | n/a | n/a | n/a | n/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 |
3D Structure (crystal) |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50214209
((R)-2-(4-butoxy-3-((2-fluoro-4-(trifluoromethyl)be...)Show SMILES CCCCOc1ccc(C[C@@H](CC)C(O)=O)cc1CNC(=O)c1ccc(cc1F)C(F)(F)F Show InChI InChI=1S/C24H27F4NO4/c1-3-5-10-33-21-9-6-15(11-16(4-2)23(31)32)12-17(21)14-29-22(30)19-8-7-18(13-20(19)25)24(26,27)28/h6-9,12-13,16H,3-5,10-11,14H2,1-2H3,(H,29,30)(H,31,32)/t16-/m1/s1 | PDB
UniProtKB/SwissProt
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PubMed
| n/a | n/a | n/a | n/a | 620 | n/a | n/a | n/a | n/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
(Homo sapiens (Human)) | BDBM50214199
(2-{4-n-butoxy-3-[(2-fluoro-4-trifluoromethylbenzoy...)Show SMILES CCCCC(Cc1ccc(OC)c(CNC(=O)c2ccc(cc2F)C(F)(F)F)c1)C(O)=O |w:4.4| Show InChI InChI=1S/C23H25F4NO4/c1-3-4-5-15(22(30)31)10-14-6-9-20(32-2)16(11-14)13-28-21(29)18-8-7-17(12-19(18)24)23(25,26)27/h6-9,11-12,15H,3-5,10,13H2,1-2H3,(H,28,29)(H,30,31) | PDB
UniProtKB/SwissProt
antibodypedia
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Similars
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PubMed
| n/a | n/a | n/a | n/a | 140 | n/a | n/a | n/a | n/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)) | BDBM50214196
(2-{4-benzyloxy-3-[(4-trifluoromethylbenzoylamino)m...)Show SMILES CCC(Cc1ccc(OCc2ccccc2)c(CNC(=O)c2ccc(cc2)C(F)(F)F)c1)C(O)=O |w:2.2| Show InChI InChI=1S/C27H26F3NO4/c1-2-20(26(33)34)14-19-8-13-24(35-17-18-6-4-3-5-7-18)22(15-19)16-31-25(32)21-9-11-23(12-10-21)27(28,29)30/h3-13,15,20H,2,14,16-17H2,1H3,(H,31,32)(H,33,34) | PDB
UniProtKB/SwissProt
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| n/a | n/a | n/a | n/a | 110 | n/a | n/a | n/a | n/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)) | BDBM28661
(2-{2-methyl-4-[({4-methyl-2-[4-(trifluoromethyl)ph...)Show SMILES Cc1nc(sc1CSc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C21H18F3NO3S2/c1-12-9-16(7-8-17(12)28-10-19(26)27)29-11-18-13(2)25-20(30-18)14-3-5-15(6-4-14)21(22,23)24/h3-9H,10-11H2,1-2H3,(H,26,27) | PDB
UniProtKB/SwissProt
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MCE
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| PDB
Article
PubMed
| n/a | n/a | n/a | n/a | 1.80 | n/a | n/a | n/a | n/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 |
3D Structure (crystal) |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50131739
((+/-)-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
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 2.60E+3 | n/a | n/a | n/a | n/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
(Homo sapiens (Human)) | BDBM50214201
(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 |w:4.4| 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
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PubMed
| n/a | n/a | n/a | n/a | 230 | n/a | n/a | n/a | n/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
(Homo sapiens (Human)) | BDBM50214195
(2-{3-[(2-fluoro-4-trifluoromethylbenzoylamino)-met...)Show SMILES CCCOc1ccc(CC(CC)C(O)=O)cc1CNC(=O)c1ccc(cc1F)C(F)(F)F |w:9.8| Show InChI InChI=1S/C23H25F4NO4/c1-3-9-32-20-8-5-14(10-15(4-2)22(30)31)11-16(20)13-28-21(29)18-7-6-17(12-19(18)24)23(25,26)27/h5-8,11-12,15H,3-4,9-10,13H2,1-2H3,(H,28,29)(H,30,31) | PDB
UniProtKB/SwissProt
antibodypedia
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PC cid
PC sid
UniChem
Similars
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PubMed
| n/a | n/a | n/a | n/a | 41 | n/a | n/a | n/a | n/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
(Homo sapiens (Human)) | BDBM50214205
(2-(4-butoxy-3-((2-fluoro-4-(trifluoromethyl)benzam...)Show SMILES CCCCOc1ccc(CC(CC)C(O)=O)cc1CNC(=O)c1ccc(cc1F)C(F)(F)F |w:10.9| Show InChI InChI=1S/C24H27F4NO4/c1-3-5-10-33-21-9-6-15(11-16(4-2)23(31)32)12-17(21)14-29-22(30)19-8-7-18(13-20(19)25)24(26,27)28/h6-9,12-13,16H,3-5,10-11,14H2,1-2H3,(H,29,30)(H,31,32) | PDB
UniProtKB/SwissProt
antibodypedia
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PC sid
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PubMed
| n/a | n/a | n/a | n/a | 280 | n/a | n/a | n/a | n/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 gamma
(Homo sapiens (Human)) | BDBM50214206
(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
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/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
(Homo sapiens (Human)) | BDBM50214208
(2-{4-ethoxy-3-[(4-trifluoromethylbenzoylamino)-met...)Show SMILES CCOc1ccc(CC(CC)C(O)=O)cc1CNC(=O)c1ccc(cc1)C(F)(F)F |w:8.7| Show InChI InChI=1S/C22H24F3NO4/c1-3-15(21(28)29)11-14-5-10-19(30-4-2)17(12-14)13-26-20(27)16-6-8-18(9-7-16)22(23,24)25/h5-10,12,15H,3-4,11,13H2,1-2H3,(H,26,27)(H,28,29) | PDB
UniProtKB/SwissProt
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PubMed
| n/a | n/a | n/a | n/a | 12 | n/a | n/a | n/a | n/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)) | BDBM50214208
(2-{4-ethoxy-3-[(4-trifluoromethylbenzoylamino)-met...)Show SMILES CCOc1ccc(CC(CC)C(O)=O)cc1CNC(=O)c1ccc(cc1)C(F)(F)F |w:8.7| Show InChI InChI=1S/C22H24F3NO4/c1-3-15(21(28)29)11-14-5-10-19(30-4-2)17(12-14)13-26-20(27)16-6-8-18(9-7-16)22(23,24)25/h5-10,12,15H,3-4,11,13H2,1-2H3,(H,26,27)(H,28,29) | PDB
UniProtKB/SwissProt
antibodypedia
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PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 15 | n/a | n/a | n/a | n/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 gamma
(Homo sapiens (Human)) | BDBM50214207
((2S)-2-{4-butoxy-3-[({[2-fluoro-4-(trifluoromethyl...)Show SMILES CCCCOc1ccc(C[C@H](CC)C(O)=O)cc1CNC(=O)c1ccc(cc1F)C(F)(F)F Show InChI InChI=1S/C24H27F4NO4/c1-3-5-10-33-21-9-6-15(11-16(4-2)23(31)32)12-17(21)14-29-22(30)19-8-7-18(13-20(19)25)24(26,27)28/h6-9,12-13,16H,3-5,10-11,14H2,1-2H3,(H,29,30)(H,31,32)/t16-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
MMDB
PC cid
PC sid
PDB
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.10E+3 | n/a | n/a | n/a | n/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)) | BDBM50131739
((+/-)-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
antibodypedia
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PC cid
PC sid
UniChem
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PubMed
| n/a | n/a | n/a | n/a | 170 | n/a | n/a | n/a | n/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 gamma
(Homo sapiens (Human)) | BDBM50214197
(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 |w:3.3| 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
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 3.60E+3 | n/a | n/a | n/a | n/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 gamma
(Homo sapiens (Human)) | BDBM50214195
(2-{3-[(2-fluoro-4-trifluoromethylbenzoylamino)-met...)Show SMILES CCCOc1ccc(CC(CC)C(O)=O)cc1CNC(=O)c1ccc(cc1F)C(F)(F)F |w:9.8| Show InChI InChI=1S/C23H25F4NO4/c1-3-9-32-20-8-5-14(10-15(4-2)22(30)31)11-16(20)13-28-21(29)18-7-6-17(12-19(18)24)23(25,26)27/h5-8,11-12,15H,3-4,9-10,13H2,1-2H3,(H,28,29)(H,30,31) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 650 | n/a | n/a | n/a | n/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 gamma
(Homo sapiens (Human)) | BDBM50214201
(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 |w:4.4| 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
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 2.40E+3 | n/a | n/a | n/a | n/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 gamma
(Homo sapiens (Human)) | BDBM50214202
(2-{4-n-butoxy-3-[(4-trifluoromethylbenzoylamino)me...)Show SMILES CCCCOc1ccc(CC(CC)C(O)=O)cc1CNC(=O)c1ccc(cc1)C(F)(F)F |w:10.9| Show InChI InChI=1S/C24H28F3NO4/c1-3-5-12-32-21-11-6-16(13-17(4-2)23(30)31)14-19(21)15-28-22(29)18-7-9-20(10-8-18)24(25,26)27/h6-11,14,17H,3-5,12-13,15H2,1-2H3,(H,28,29)(H,30,31) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.30E+3 | n/a | n/a | n/a | n/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 gamma
(Homo sapiens (Human)) | BDBM50214200
(2-(4-butoxy-3-((2-fluoro-4-(trifluoromethyl)benzam...)Show SMILES CCCCOc1ccc(CC(CCC)C(O)=O)cc1CNC(=O)c1ccc(cc1F)C(F)(F)F |w:10.9| Show InChI InChI=1S/C25H29F4NO4/c1-3-5-11-34-22-10-7-16(12-17(6-4-2)24(32)33)13-18(22)15-30-23(31)20-9-8-19(14-21(20)26)25(27,28)29/h7-10,13-14,17H,3-6,11-12,15H2,1-2H3,(H,30,31)(H,32,33) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/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 gamma
(Homo sapiens (Human)) | BDBM28661
(2-{2-methyl-4-[({4-methyl-2-[4-(trifluoromethyl)ph...)Show SMILES Cc1nc(sc1CSc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C21H18F3NO3S2/c1-12-9-16(7-8-17(12)28-10-19(26)27)29-11-18-13(2)25-20(30-18)14-3-5-15(6-4-14)21(22,23)24/h3-9H,10-11H2,1-2H3,(H,26,27) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
DrugBank
MCE
PC cid
PC sid
PDB
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 8.60E+3 | n/a | n/a | n/a | n/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)) | BDBM50214202
(2-{4-n-butoxy-3-[(4-trifluoromethylbenzoylamino)me...)Show SMILES CCCCOc1ccc(CC(CC)C(O)=O)cc1CNC(=O)c1ccc(cc1)C(F)(F)F |w:10.9| Show InChI InChI=1S/C24H28F3NO4/c1-3-5-12-32-21-11-6-16(13-17(4-2)23(30)31)14-19(21)15-28-22(29)18-7-9-20(10-8-18)24(25,26)27/h6-11,14,17H,3-5,12-13,15H2,1-2H3,(H,28,29)(H,30,31) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 4.80 | n/a | n/a | n/a | n/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 | |
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