Found 45 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 alpha
(Homo sapiens (Human)) | BDBM50231507
((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 |r,TLB:24:27:30.29.34:32,THB:28:29:32:36.27.35,28:27:30.29.34:32,35:27:30:34.33.32,35:33:30:36.28.27,24:27:30:34.33.32| 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
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
MMDB
PC cid
PC sid
PDB
UniChem
Similars
| PDB
Article
PubMed
| n/a | n/a | n/a | n/a | 58 | n/a | n/a | n/a | n/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 Structure (crystal) |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50273018
((+/-)-2-(2-fluoro-4-methoxy-5-((4-(trifluoromethyl...)Show SMILES CCC(Cc1cc(CNC(=O)c2ccc(cc2)C(F)(F)F)c(OC)cc1F)C(O)=O Show InChI InChI=1S/C21H21F4NO4/c1-3-12(20(28)29)8-14-9-15(18(30-2)10-17(14)22)11-26-19(27)13-4-6-16(7-5-13)21(23,24)25/h4-7,9-10,12H,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
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.10E+3 | n/a | n/a | n/a | n/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
(Homo sapiens (Human)) | BDBM50273054
((+/-)-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 |TLB:14:17:20.19.24:22,THB:18:19:22:26.17.25,18:17:20.19.24:22,25:17:20:24.23.22,25:23:20:26.18.17,14:17:20:24.23.22| 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
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 13 | n/a | n/a | n/a | n/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
(Homo sapiens (Human)) | BDBM50273019
((+/-)-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 |TLB:18:22:25.24.29:27,THB:23:24:27:31.22.30,23:22:25.24.29:27,30:22:25:29.28.27,30:28:25:31.23.22,18:22:25:29.28.27| 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
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 60 | n/a | n/a | n/a | n/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
(Homo sapiens (Human)) | BDBM50273018
((+/-)-2-(2-fluoro-4-methoxy-5-((4-(trifluoromethyl...)Show SMILES CCC(Cc1cc(CNC(=O)c2ccc(cc2)C(F)(F)F)c(OC)cc1F)C(O)=O Show InChI InChI=1S/C21H21F4NO4/c1-3-12(20(28)29)8-14-9-15(18(30-2)10-17(14)22)11-26-19(27)13-4-6-16(7-5-13)21(23,24)25/h4-7,9-10,12H,3,8,11H2,1-2H3,(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 | 3.60 | n/a | n/a | n/a | n/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 gamma
(Homo sapiens (Human)) | BDBM50273125
((R)-2-{5-[(4-Adamantan-1-yl-2-fluoro-benzoylamino)...)Show SMILES CCCOc1cc(F)c(C[C@@H](CC)C(O)=O)cc1CNC(=O)c1ccc(cc1F)C12CC3CC(CC(C3)C1)C2 |r,TLB:25:29:32.31.36:34,THB:30:31:34:38.29.37,30:29:32.31.36:34,37:29:32:36.35.34,37:35:32:38.30.29,25:29:32:36.35.34| Show InChI InChI=1S/C32H39F2NO4/c1-3-7-39-29-14-27(33)23(11-22(4-2)31(37)38)12-24(29)18-35-30(36)26-6-5-25(13-28(26)34)32-15-19-8-20(16-32)10-21(9-19)17-32/h5-6,12-14,19-22H,3-4,7-11,15-18H2,1-2H3,(H,35,36)(H,37,38)/t19?,20?,21?,22-,32?/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 | 160 | n/a | n/a | n/a | n/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 gamma
(Homo sapiens (Human)) | BDBM50273055
((+/-)-2-{5-[(4-Adamantan-1-yl-benzoylamino)-methyl...)Show SMILES CCOc1cc(F)c(CC(CC)C(O)=O)cc1CNC(=O)c1ccc(cc1)C12CC3CC(CC(C3)C1)C2 |TLB:24:27:30.29.34:32,THB:28:29:32:36.27.35,28:27:30.29.34:32,35:27:30:34.33.32,35:33:30:36.28.27,24:27:30:34.33.32| Show InChI InChI=1S/C31H38FNO4/c1-3-22(30(35)36)12-24-13-25(28(37-4-2)14-27(24)32)18-33-29(34)23-5-7-26(8-6-23)31-15-19-9-20(16-31)11-21(10-19)17-31/h5-8,13-14,19-22H,3-4,9-12,15-18H2,1-2H3,(H,33,34)(H,35,36) | 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 | 24 | n/a | n/a | n/a | n/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 gamma
(Homo sapiens (Human)) | BDBM50272978
((+/-)-2-(3-fluoro-4-methoxy-5-((4-(trifluoromethyl...)Show SMILES CCC(Cc1cc(F)c(OC)c(CNC(=O)c2ccc(cc2)C(F)(F)F)c1)C(O)=O Show InChI InChI=1S/C21H21F4NO4/c1-3-13(20(28)29)8-12-9-15(18(30-2)17(22)10-12)11-26-19(27)14-4-6-16(7-5-14)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
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/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
(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
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 10 | n/a | n/a | n/a | n/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
((+/-)-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
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 130 | n/a | n/a | n/a | n/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)) | BDBM50273091
((S)-2-{5-[(4-Adamantan-1-yl-2-fluoro-benzoylamino)...)Show SMILES CCCOc1cc(F)c(C[C@H](CC)C(O)=O)cc1CNC(=O)c1ccc(cc1F)C12CC3CC(CC(C3)C1)C2 |r,TLB:25:29:32.31.36:34,THB:30:31:34:38.29.37,30:29:32.31.36:34,37:29:32:36.35.34,37:35:32:38.30.29,25:29:32:36.35.34| Show InChI InChI=1S/C32H39F2NO4/c1-3-7-39-29-14-27(33)23(11-22(4-2)31(37)38)12-24(29)18-35-30(36)26-6-5-25(13-28(26)34)32-15-19-8-20(16-32)10-21(9-19)17-32/h5-6,12-14,19-22H,3-4,7-11,15-18H2,1-2H3,(H,35,36)(H,37,38)/t19?,20?,21?,22-,32?/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 25 | n/a | n/a | n/a | n/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)) | BDBM50273090
((+/-)-2-{5-[(4-Adamantan-1-yl-2-fluoro-benzoylamin...)Show SMILES CCCOc1cc(F)c(CC(CC)C(O)=O)cc1CNC(=O)c1ccc(cc1F)C12CC3CC(CC(C3)C1)C2 |TLB:25:29:32.31.36:34,THB:30:31:34:38.29.37,30:29:32.31.36:34,37:29:32:36.35.34,37:35:32:38.30.29,25:29:32:36.35.34| Show InChI InChI=1S/C32H39F2NO4/c1-3-7-39-29-14-27(33)23(11-22(4-2)31(37)38)12-24(29)18-35-30(36)26-6-5-25(13-28(26)34)32-15-19-8-20(16-32)10-21(9-19)17-32/h5-6,12-14,19-22H,3-4,7-11,15-18H2,1-2H3,(H,35,36)(H,37,38) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 28 | n/a | n/a | n/a | n/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
((+/-)-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 |TLB:18:22:25.24.29:27,THB:23:24:27:31.22.30,23:22:25.24.29:27,30:22:25:29.28.27,30:28:25:31.23.22,18:22:25:29.28.27| 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
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 550 | n/a | n/a | n/a | n/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)) | 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
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
PDB
UniChem
Similars
| PDB
Article
PubMed
| n/a | n/a | n/a | n/a | 29 | n/a | n/a | n/a | n/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 |
3D Structure (crystal) |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50273090
((+/-)-2-{5-[(4-Adamantan-1-yl-2-fluoro-benzoylamin...)Show SMILES CCCOc1cc(F)c(CC(CC)C(O)=O)cc1CNC(=O)c1ccc(cc1F)C12CC3CC(CC(C3)C1)C2 |TLB:25:29:32.31.36:34,THB:30:31:34:38.29.37,30:29:32.31.36:34,37:29:32:36.35.34,37:35:32:38.30.29,25:29:32:36.35.34| Show InChI InChI=1S/C32H39F2NO4/c1-3-7-39-29-14-27(33)23(11-22(4-2)31(37)38)12-24(29)18-35-30(36)26-6-5-25(13-28(26)34)32-15-19-8-20(16-32)10-21(9-19)17-32/h5-6,12-14,19-22H,3-4,7-11,15-18H2,1-2H3,(H,35,36)(H,37,38) | 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 | 35 | n/a | n/a | n/a | n/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 gamma
(Homo sapiens (Human)) | BDBM50273089
((+/-)-2-{5-[(4-Adamantan-1-yl-2-fluoro-benzoylamin...)Show SMILES CCOc1cc(F)c(CC(CC)C(O)=O)cc1CNC(=O)c1ccc(cc1F)C12CC3CC(CC(C3)C1)C2 |TLB:24:28:31.30.35:33,THB:29:30:33:37.28.36,29:28:31.30.35:33,36:28:31:35.34.33,36:34:31:37.29.28,24:28:31:35.34.33| Show InChI InChI=1S/C31H37F2NO4/c1-3-21(30(36)37)10-22-11-23(28(38-4-2)13-26(22)32)17-34-29(35)25-6-5-24(12-27(25)33)31-14-18-7-19(15-31)9-20(8-18)16-31/h5-6,11-13,18-21H,3-4,7-10,14-17H2,1-2H3,(H,34,35)(H,36,37) | 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 | 22 | n/a | n/a | n/a | n/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 gamma
(Homo sapiens (Human)) | BDBM50273054
((+/-)-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 |TLB:14:17:20.19.24:22,THB:18:19:22:26.17.25,18:17:20.19.24:22,25:17:20:24.23.22,25:23:20:26.18.17,14:17:20:24.23.22| 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
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 36 | n/a | n/a | n/a | n/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 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 |
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
(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
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
PDB
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 7.90 | n/a | n/a | n/a | n/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)) | BDBM50273056
((+/-)-2-{5-[(4-Adamantan-1-yl-benzoylamino)-methyl...)Show SMILES CCCOc1cc(F)c(CC(CC)C(O)=O)cc1CNC(=O)c1ccc(cc1)C12CC3CC(CC(C3)C1)C2 |TLB:25:28:31.30.35:33,THB:29:30:33:37.28.36,29:28:31.30.35:33,36:28:31:35.34.33,36:34:31:37.29.28,25:28:31:35.34.33| Show InChI InChI=1S/C32H40FNO4/c1-3-9-38-29-15-28(33)25(13-23(4-2)31(36)37)14-26(29)19-34-30(35)24-5-7-27(8-6-24)32-16-20-10-21(17-32)12-22(11-20)18-32/h5-8,14-15,20-23H,3-4,9-13,16-19H2,1-2H3,(H,34,35)(H,36,37) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 60 | n/a | n/a | n/a | n/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 gamma
(Homo sapiens (Human)) | BDBM50273019
((+/-)-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 |TLB:18:22:25.24.29:27,THB:23:24:27:31.22.30,23:22:25.24.29:27,30:22:25:29.28.27,30:28:25:31.23.22,18:22:25:29.28.27| 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
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 140 | n/a | n/a | n/a | n/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
(Homo sapiens (Human)) | BDBM50273125
((R)-2-{5-[(4-Adamantan-1-yl-2-fluoro-benzoylamino)...)Show SMILES CCCOc1cc(F)c(C[C@@H](CC)C(O)=O)cc1CNC(=O)c1ccc(cc1F)C12CC3CC(CC(C3)C1)C2 |r,TLB:25:29:32.31.36:34,THB:30:31:34:38.29.37,30:29:32.31.36:34,37:29:32:36.35.34,37:35:32:38.30.29,25:29:32:36.35.34| Show InChI InChI=1S/C32H39F2NO4/c1-3-7-39-29-14-27(33)23(11-22(4-2)31(37)38)12-24(29)18-35-30(36)26-6-5-25(13-28(26)34)32-15-19-8-20(16-32)10-21(9-19)17-32/h5-6,12-14,19-22H,3-4,7-11,15-18H2,1-2H3,(H,35,36)(H,37,38)/t19?,20?,21?,22-,32?/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 | 200 | n/a | n/a | n/a | n/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
(Homo sapiens (Human)) | BDBM50273020
((+/-)-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 |TLB:19:22:25.24.29:27,THB:23:24:27:31.22.30,23:22:25.24.29:27,30:22:25:29.28.27,30:28:25:31.23.22,19:22:25:29.28.27| 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
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 260 | n/a | n/a | n/a | n/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
(Homo sapiens (Human)) | BDBM50231513
((+/-)-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 |TLB:18:21:24.23.28:26,THB:22:23:26:30.21.29,22:21:24.23.28:26,29:21:24:28.27.26,29:27:24:30.22.21,18:21:24:28.27.26| 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
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 53 | n/a | n/a | n/a | n/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)) | BDBM50273089
((+/-)-2-{5-[(4-Adamantan-1-yl-2-fluoro-benzoylamin...)Show SMILES CCOc1cc(F)c(CC(CC)C(O)=O)cc1CNC(=O)c1ccc(cc1F)C12CC3CC(CC(C3)C1)C2 |TLB:24:28:31.30.35:33,THB:29:30:33:37.28.36,29:28:31.30.35:33,36:28:31:35.34.33,36:34:31:37.29.28,24:28:31:35.34.33| Show InChI InChI=1S/C31H37F2NO4/c1-3-21(30(36)37)10-22-11-23(28(38-4-2)13-26(22)32)17-34-29(35)25-6-5-24(12-27(25)33)31-14-18-7-19(15-31)9-20(8-18)16-31/h5-6,11-13,18-21H,3-4,7-10,14-17H2,1-2H3,(H,34,35)(H,36,37) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 55 | n/a | n/a | n/a | n/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)) | BDBM50273055
((+/-)-2-{5-[(4-Adamantan-1-yl-benzoylamino)-methyl...)Show SMILES CCOc1cc(F)c(CC(CC)C(O)=O)cc1CNC(=O)c1ccc(cc1)C12CC3CC(CC(C3)C1)C2 |TLB:24:27:30.29.34:32,THB:28:29:32:36.27.35,28:27:30.29.34:32,35:27:30:34.33.32,35:33:30:36.28.27,24:27:30:34.33.32| Show InChI InChI=1S/C31H38FNO4/c1-3-22(30(35)36)12-24-13-25(28(37-4-2)14-27(24)32)18-33-29(34)23-5-7-26(8-6-23)31-15-19-9-20(16-31)11-21(10-19)17-31/h5-8,13-14,19-22H,3-4,9-12,15-18H2,1-2H3,(H,33,34)(H,35,36) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 94 | n/a | n/a | n/a | n/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
((+/-)-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 |TLB:14:17:20.19.24:22,THB:18:19:22:26.17.25,18:17:20.19.24:22,25:17:20:24.23.22,25:23:20:26.18.17,14:17:20:24.23.22| 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
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 280 | n/a | n/a | n/a | n/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 gamma
(Homo sapiens (Human)) | BDBM50231507
((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 |r,TLB:24:27:30.29.34:32,THB:28:29:32:36.27.35,28:27:30.29.34:32,35:27:30:34.33.32,35:33:30:36.28.27,24:27:30:34.33.32| 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
AffyNet
| CHEMBL
MMDB
PC cid
PC sid
PDB
UniChem
Similars
| PDB
Article
PubMed
| n/a | n/a | n/a | n/a | 43 | n/a | n/a | n/a | n/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 Structure (crystal) |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50273091
((S)-2-{5-[(4-Adamantan-1-yl-2-fluoro-benzoylamino)...)Show SMILES CCCOc1cc(F)c(C[C@H](CC)C(O)=O)cc1CNC(=O)c1ccc(cc1F)C12CC3CC(CC(C3)C1)C2 |r,TLB:25:29:32.31.36:34,THB:30:31:34:38.29.37,30:29:32.31.36:34,37:29:32:36.35.34,37:35:32:38.30.29,25:29:32:36.35.34| Show InChI InChI=1S/C32H39F2NO4/c1-3-7-39-29-14-27(33)23(11-22(4-2)31(37)38)12-24(29)18-35-30(36)26-6-5-25(13-28(26)34)32-15-19-8-20(16-32)10-21(9-19)17-32/h5-6,12-14,19-22H,3-4,7-11,15-18H2,1-2H3,(H,35,36)(H,37,38)/t19?,20?,21?,22-,32?/m0/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 | 38 | n/a | n/a | n/a | n/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 gamma
(Homo sapiens (Human)) | BDBM50273056
((+/-)-2-{5-[(4-Adamantan-1-yl-benzoylamino)-methyl...)Show SMILES CCCOc1cc(F)c(CC(CC)C(O)=O)cc1CNC(=O)c1ccc(cc1)C12CC3CC(CC(C3)C1)C2 |TLB:25:28:31.30.35:33,THB:29:30:33:37.28.36,29:28:31.30.35:33,36:28:31:35.34.33,36:34:31:37.29.28,25:28:31:35.34.33| Show InChI InChI=1S/C32H40FNO4/c1-3-9-38-29-15-28(33)25(13-23(4-2)31(36)37)14-26(29)19-34-30(35)24-5-7-27(8-6-24)32-16-20-10-21(17-32)12-22(11-20)18-32/h5-8,14-15,20-23H,3-4,9-13,16-19H2,1-2H3,(H,34,35)(H,36,37) | 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 | 15 | n/a | n/a | n/a | n/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
(Homo sapiens (Human)) | BDBM50273056
((+/-)-2-{5-[(4-Adamantan-1-yl-benzoylamino)-methyl...)Show SMILES CCCOc1cc(F)c(CC(CC)C(O)=O)cc1CNC(=O)c1ccc(cc1)C12CC3CC(CC(C3)C1)C2 |TLB:25:28:31.30.35:33,THB:29:30:33:37.28.36,29:28:31.30.35:33,36:28:31:35.34.33,36:34:31:37.29.28,25:28:31:35.34.33| Show InChI InChI=1S/C32H40FNO4/c1-3-9-38-29-15-28(33)25(13-23(4-2)31(36)37)14-26(29)19-34-30(35)24-5-7-27(8-6-24)32-16-20-10-21(17-32)12-22(11-20)18-32/h5-8,14-15,20-23H,3-4,9-13,16-19H2,1-2H3,(H,34,35)(H,36,37) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 17 | n/a | n/a | n/a | n/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
(Homo sapiens (Human)) | BDBM50272978
((+/-)-2-(3-fluoro-4-methoxy-5-((4-(trifluoromethyl...)Show SMILES CCC(Cc1cc(F)c(OC)c(CNC(=O)c2ccc(cc2)C(F)(F)F)c1)C(O)=O Show InChI InChI=1S/C21H21F4NO4/c1-3-13(20(28)29)8-12-9-15(18(30-2)17(22)10-12)11-26-19(27)14-4-6-16(7-5-14)21(23,24)25/h4-7,9-10,13H,3,8,11H2,1-2H3,(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 | 54 | n/a | n/a | n/a | n/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)) | BDBM50273020
((+/-)-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 |TLB:19:22:25.24.29:27,THB:23:24:27:31.22.30,23:22:25.24.29:27,30:22:25:29.28.27,30:28:25:31.23.22,19:22:25:29.28.27| 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
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 2.20E+3 | n/a | n/a | n/a | n/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 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 | 2.60E+3 | n/a | n/a | n/a | n/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 delta
(Homo sapiens (Human)) | BDBM50273125
((R)-2-{5-[(4-Adamantan-1-yl-2-fluoro-benzoylamino)...)Show SMILES CCCOc1cc(F)c(C[C@@H](CC)C(O)=O)cc1CNC(=O)c1ccc(cc1F)C12CC3CC(CC(C3)C1)C2 |r,TLB:25:29:32.31.36:34,THB:30:31:34:38.29.37,30:29:32.31.36:34,37:29:32:36.35.34,37:35:32:38.30.29,25:29:32:36.35.34| Show InChI InChI=1S/C32H39F2NO4/c1-3-7-39-29-14-27(33)23(11-22(4-2)31(37)38)12-24(29)18-35-30(36)26-6-5-25(13-28(26)34)32-15-19-8-20(16-32)10-21(9-19)17-32/h5-6,12-14,19-22H,3-4,7-11,15-18H2,1-2H3,(H,35,36)(H,37,38)/t19?,20?,21?,22-,32?/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 | 180 | n/a | n/a | n/a | n/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
((+/-)-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 |TLB:18:21:24.23.28:26,THB:22:23:26:30.21.29,22:21:24.23.28:26,29:21:24:28.27.26,29:27:24:30.22.21,18:21:24:28.27.26| 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
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 940 | n/a | n/a | n/a | n/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)) | BDBM50272978
((+/-)-2-(3-fluoro-4-methoxy-5-((4-(trifluoromethyl...)Show SMILES CCC(Cc1cc(F)c(OC)c(CNC(=O)c2ccc(cc2)C(F)(F)F)c1)C(O)=O Show InChI InChI=1S/C21H21F4NO4/c1-3-13(20(28)29)8-12-9-15(18(30-2)17(22)10-12)11-26-19(27)14-4-6-16(7-5-14)21(23,24)25/h4-7,9-10,13H,3,8,11H2,1-2H3,(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 | 59 | n/a | n/a | n/a | n/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 alpha
(Homo sapiens (Human)) | BDBM50273091
((S)-2-{5-[(4-Adamantan-1-yl-2-fluoro-benzoylamino)...)Show SMILES CCCOc1cc(F)c(C[C@H](CC)C(O)=O)cc1CNC(=O)c1ccc(cc1F)C12CC3CC(CC(C3)C1)C2 |r,TLB:25:29:32.31.36:34,THB:30:31:34:38.29.37,30:29:32.31.36:34,37:29:32:36.35.34,37:35:32:38.30.29,25:29:32:36.35.34| Show InChI InChI=1S/C32H39F2NO4/c1-3-7-39-29-14-27(33)23(11-22(4-2)31(37)38)12-24(29)18-35-30(36)26-6-5-25(13-28(26)34)32-15-19-8-20(16-32)10-21(9-19)17-32/h5-6,12-14,19-22H,3-4,7-11,15-18H2,1-2H3,(H,35,36)(H,37,38)/t19?,20?,21?,22-,32?/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 12 | n/a | n/a | n/a | n/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
(Homo sapiens (Human)) | BDBM50273089
((+/-)-2-{5-[(4-Adamantan-1-yl-2-fluoro-benzoylamin...)Show SMILES CCOc1cc(F)c(CC(CC)C(O)=O)cc1CNC(=O)c1ccc(cc1F)C12CC3CC(CC(C3)C1)C2 |TLB:24:28:31.30.35:33,THB:29:30:33:37.28.36,29:28:31.30.35:33,36:28:31:35.34.33,36:34:31:37.29.28,24:28:31:35.34.33| Show InChI InChI=1S/C31H37F2NO4/c1-3-21(30(36)37)10-22-11-23(28(38-4-2)13-26(22)32)17-34-29(35)25-6-5-24(12-27(25)33)31-14-18-7-19(15-31)9-20(8-18)16-31/h5-6,11-13,18-21H,3-4,7-10,14-17H2,1-2H3,(H,34,35)(H,36,37) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 7.5 | n/a | n/a | n/a | n/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)) | BDBM50273018
((+/-)-2-(2-fluoro-4-methoxy-5-((4-(trifluoromethyl...)Show SMILES CCC(Cc1cc(CNC(=O)c2ccc(cc2)C(F)(F)F)c(OC)cc1F)C(O)=O Show InChI InChI=1S/C21H21F4NO4/c1-3-12(20(28)29)8-14-9-15(18(30-2)10-17(14)22)11-26-19(27)13-4-6-16(7-5-13)21(23,24)25/h4-7,9-10,12H,3,8,11H2,1-2H3,(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 | 20 | n/a | n/a | n/a | n/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 gamma
(Homo sapiens (Human)) | BDBM50273020
((+/-)-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 |TLB:19:22:25.24.29:27,THB:23:24:27:31.22.30,23:22:25.24.29:27,30:22:25:29.28.27,30:28:25:31.23.22,19:22:25:29.28.27| 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
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 190 | n/a | n/a | n/a | n/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
(Homo sapiens (Human)) | BDBM50273055
((+/-)-2-{5-[(4-Adamantan-1-yl-benzoylamino)-methyl...)Show SMILES CCOc1cc(F)c(CC(CC)C(O)=O)cc1CNC(=O)c1ccc(cc1)C12CC3CC(CC(C3)C1)C2 |TLB:24:27:30.29.34:32,THB:28:29:32:36.27.35,28:27:30.29.34:32,35:27:30:34.33.32,35:33:30:36.28.27,24:27:30:34.33.32| Show InChI InChI=1S/C31H38FNO4/c1-3-22(30(35)36)12-24-13-25(28(37-4-2)14-27(24)32)18-33-29(34)23-5-7-26(8-6-23)31-15-19-9-20(16-31)11-21(10-19)17-31/h5-8,13-14,19-22H,3-4,9-12,15-18H2,1-2H3,(H,33,34)(H,35,36) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 7.10 | n/a | n/a | n/a | n/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
((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 |r,TLB:24:27:30.29.34:32,THB:28:29:32:36.27.35,28:27:30.29.34:32,35:27:30:34.33.32,35:33:30:36.28.27,24:27:30:34.33.32| 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
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
MMDB
PC cid
PC sid
PDB
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 120 | n/a | n/a | n/a | n/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 gamma
(Homo sapiens (Human)) | BDBM50231513
((+/-)-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 |TLB:18:21:24.23.28:26,THB:22:23:26:30.21.29,22:21:24.23.28:26,29:21:24:28.27.26,29:27:24:30.22.21,18:21:24:28.27.26| 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
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 110 | n/a | n/a | n/a | n/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
(Homo sapiens (Human)) | BDBM50273090
((+/-)-2-{5-[(4-Adamantan-1-yl-2-fluoro-benzoylamin...)Show SMILES CCCOc1cc(F)c(CC(CC)C(O)=O)cc1CNC(=O)c1ccc(cc1F)C12CC3CC(CC(C3)C1)C2 |TLB:25:29:32.31.36:34,THB:30:31:34:38.29.37,30:29:32.31.36:34,37:29:32:36.35.34,37:35:32:38.30.29,25:29:32:36.35.34| Show InChI InChI=1S/C32H39F2NO4/c1-3-7-39-29-14-27(33)23(11-22(4-2)31(37)38)12-24(29)18-35-30(36)26-6-5-25(13-28(26)34)32-15-19-8-20(16-32)10-21(9-19)17-32/h5-6,12-14,19-22H,3-4,7-11,15-18H2,1-2H3,(H,35,36)(H,37,38) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 13 | n/a | n/a | n/a | n/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 |
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Ligand-Target Pair | |
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