Found 26 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 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
antibodypedia
GoogleScholar
AffyNet 
| Purchase
CHEMBL
DrugBank
MCE
PC cid
PC sid
PDB
UniChem
Patents
Similars
| PDB
Article
PubMed
| n/a | n/a | n/a | n/a | 1 | n/a | n/a | n/a | n/a |
Université d'Orléans
Curated by ChEMBL
| Assay Description
Activity at PPARbeta/delta by luciferase reporter gene transactivation assay in COS7 cells |
Bioorg Med Chem Lett 16: 4528-32 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.028
BindingDB Entry DOI: 10.7270/Q28915HC |
More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50085041
(2-(4-(3-(4-acetyl-3-hydroxy-2-propylphenoxy)propox...)Show SMILES CCCc1c(O)c(ccc1OCCCOc1ccc(OCC(O)=O)cc1)C(C)=O Show InChI InChI=1S/C22H26O7/c1-3-5-19-20(11-10-18(15(2)23)22(19)26)28-13-4-12-27-16-6-8-17(9-7-16)29-14-21(24)25/h6-11,26H,3-5,12-14H2,1-2H3,(H,24,25) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
DrugBank
MCE
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| PDB
Article
PubMed
| n/a | n/a | n/a | n/a | 125 | n/a | n/a | n/a | n/a |
Université d'Orléans
Curated by ChEMBL
| Assay Description
Activity at PPARbeta/delta by luciferase reporter gene transactivation assay in COS7 cells |
Bioorg Med Chem Lett 16: 4528-32 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.028
BindingDB Entry DOI: 10.7270/Q28915HC |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50189968
(CHEMBL212993 | methyl 2-(4-(3-(6-acetyl-5-hydroxy-...)Show SMILES CCCc1c(OCCCOc2ccc(OCC(=O)OC)cc2)cnc(C(C)=O)c1O Show InChI InChI=1S/C22H27NO7/c1-4-6-18-19(13-23-21(15(2)24)22(18)26)29-12-5-11-28-16-7-9-17(10-8-16)30-14-20(25)27-3/h7-10,13,26H,4-6,11-12,14H2,1-3H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 757 | n/a | n/a | n/a | n/a |
Université d'Orléans
Curated by ChEMBL
| Assay Description
Activity at PPARgamma by luciferase reporter gene transactivation assay in COS7 cells |
Bioorg Med Chem Lett 16: 4528-32 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.028
BindingDB Entry DOI: 10.7270/Q28915HC |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50189964
(CHEMBL214394 | methyl 2-(2-methyl-4-(3-(2-propyl-4...)Show SMILES CCCc1cc(ccc1OCCCOc1ccc(OCC(=O)OC)c(C)c1)C(F)(F)F Show InChI InChI=1S/C23H27F3O5/c1-4-6-17-14-18(23(24,25)26)7-9-21(17)30-12-5-11-29-19-8-10-20(16(2)13-19)31-15-22(27)28-3/h7-10,13-14H,4-6,11-12,15H2,1-3H3 | 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 | 1.26E+3 | n/a | n/a | n/a | n/a |
Université d'Orléans
Curated by ChEMBL
| Assay Description
Activity at PPARgamma by luciferase reporter gene transactivation assay in COS7 cells |
Bioorg Med Chem Lett 16: 4528-32 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.028
BindingDB Entry DOI: 10.7270/Q28915HC |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50189969
(2-(4-(3-(4-acetyl-3-hydroxyphenoxy)propoxy)phenoxy...)Show InChI InChI=1S/C19H20O7/c1-13(20)17-8-7-16(11-18(17)21)25-10-2-9-24-14-3-5-15(6-4-14)26-12-19(22)23/h3-8,11,21H,2,9-10,12H2,1H3,(H,22,23) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.00E+4 | n/a | n/a | n/a | n/a |
Université d'Orléans
Curated by ChEMBL
| Assay Description
Activity at PPARbeta/delta by luciferase reporter gene transactivation assay in COS7 cells |
Bioorg Med Chem Lett 16: 4528-32 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.028
BindingDB Entry DOI: 10.7270/Q28915HC |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50189971
(CHEMBL213132 | methyl 2-(4-(3-(2-propylphenoxy)pro...)Show InChI InChI=1S/C21H26O5/c1-3-7-17-8-4-5-9-20(17)25-15-6-14-24-18-10-12-19(13-11-18)26-16-21(22)23-2/h4-5,8-13H,3,6-7,14-16H2,1-2H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.05E+3 | n/a | n/a | n/a | n/a |
Université d'Orléans
Curated by ChEMBL
| Assay Description
Activity at PPARbeta/delta by luciferase reporter gene transactivation assay in COS7 cells |
Bioorg Med Chem Lett 16: 4528-32 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.028
BindingDB Entry DOI: 10.7270/Q28915HC |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50189968
(CHEMBL212993 | methyl 2-(4-(3-(6-acetyl-5-hydroxy-...)Show SMILES CCCc1c(OCCCOc2ccc(OCC(=O)OC)cc2)cnc(C(C)=O)c1O Show InChI InChI=1S/C22H27NO7/c1-4-6-18-19(13-23-21(15(2)24)22(18)26)29-12-5-11-28-16-7-9-17(10-8-16)30-14-20(25)27-3/h7-10,13,26H,4-6,11-12,14H2,1-3H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 8.39E+3 | n/a | n/a | n/a | n/a |
Université d'Orléans
Curated by ChEMBL
| Assay Description
Activity at PPARalpha by luciferase reporter gene transactivation assay in COS7 cells |
Bioorg Med Chem Lett 16: 4528-32 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.028
BindingDB Entry DOI: 10.7270/Q28915HC |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50189964
(CHEMBL214394 | methyl 2-(2-methyl-4-(3-(2-propyl-4...)Show SMILES CCCc1cc(ccc1OCCCOc1ccc(OCC(=O)OC)c(C)c1)C(F)(F)F Show InChI InChI=1S/C23H27F3O5/c1-4-6-17-14-18(23(24,25)26)7-9-21(17)30-12-5-11-29-19-8-10-20(16(2)13-19)31-15-22(27)28-3/h7-10,13-14H,4-6,11-12,15H2,1-3H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.01E+3 | n/a | n/a | n/a | n/a |
Université d'Orléans
Curated by ChEMBL
| Assay Description
Activity at PPARalpha by luciferase reporter gene transactivation assay in COS7 cells |
Bioorg Med Chem Lett 16: 4528-32 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.028
BindingDB Entry DOI: 10.7270/Q28915HC |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50189966
(2-(2-methyl-4-(3-(2-propyl-4-(trifluoromethyl)phen...)Show SMILES CCCc1cc(ccc1OCCCOc1ccc(OCC(O)=O)c(C)c1)C(F)(F)F Show InChI InChI=1S/C22H25F3O5/c1-3-5-16-13-17(22(23,24)25)6-8-20(16)29-11-4-10-28-18-7-9-19(15(2)12-18)30-14-21(26)27/h6-9,12-13H,3-5,10-11,14H2,1-2H3,(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 | 7 | n/a | n/a | n/a | n/a |
Université d'Orléans
Curated by ChEMBL
| Assay Description
Activity at PPARbeta/delta by luciferase reporter gene transactivation assay in COS7 cells |
Bioorg Med Chem Lett 16: 4528-32 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.028
BindingDB Entry DOI: 10.7270/Q28915HC |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50189967
(2-(2-methyl-4-(3-(4-propyl-6-(trifluoromethyl)pyri...)Show SMILES CCCc1cc(ncc1OCCCOc1ccc(OCC(O)=O)c(C)c1)C(F)(F)F Show InChI InChI=1S/C21H24F3NO5/c1-3-5-15-11-19(21(22,23)24)25-12-18(15)29-9-4-8-28-16-6-7-17(14(2)10-16)30-13-20(26)27/h6-7,10-12H,3-5,8-9,13H2,1-2H3,(H,26,27) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 15 | n/a | n/a | n/a | n/a |
Université d'Orléans
Curated by ChEMBL
| Assay Description
Activity at PPARbeta/delta by luciferase reporter gene transactivation assay in COS7 cells |
Bioorg Med Chem Lett 16: 4528-32 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.028
BindingDB Entry DOI: 10.7270/Q28915HC |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50189968
(CHEMBL212993 | methyl 2-(4-(3-(6-acetyl-5-hydroxy-...)Show SMILES CCCc1c(OCCCOc2ccc(OCC(=O)OC)cc2)cnc(C(C)=O)c1O Show InChI InChI=1S/C22H27NO7/c1-4-6-18-19(13-23-21(15(2)24)22(18)26)29-12-5-11-28-16-7-9-17(10-8-16)30-14-20(25)27-3/h7-10,13,26H,4-6,11-12,14H2,1-3H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 82 | n/a | n/a | n/a | n/a |
Université d'Orléans
Curated by ChEMBL
| Assay Description
Activity at PPARbeta/delta by luciferase reporter gene transactivation assay in COS7 cells |
Bioorg Med Chem Lett 16: 4528-32 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.028
BindingDB Entry DOI: 10.7270/Q28915HC |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50189966
(2-(2-methyl-4-(3-(2-propyl-4-(trifluoromethyl)phen...)Show SMILES CCCc1cc(ccc1OCCCOc1ccc(OCC(O)=O)c(C)c1)C(F)(F)F Show InChI InChI=1S/C22H25F3O5/c1-3-5-16-13-17(22(23,24)25)6-8-20(16)29-11-4-10-28-18-7-9-19(15(2)12-18)30-14-21(26)27/h6-9,12-13H,3-5,10-11,14H2,1-2H3,(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 | 153 | n/a | n/a | n/a | n/a |
Université d'Orléans
Curated by ChEMBL
| Assay Description
Activity at PPARgamma by luciferase reporter gene transactivation assay in COS7 cells |
Bioorg Med Chem Lett 16: 4528-32 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.028
BindingDB Entry DOI: 10.7270/Q28915HC |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50085041
(2-(4-(3-(4-acetyl-3-hydroxy-2-propylphenoxy)propox...)Show SMILES CCCc1c(O)c(ccc1OCCCOc1ccc(OCC(O)=O)cc1)C(C)=O Show InChI InChI=1S/C22H26O7/c1-3-5-19-20(11-10-18(15(2)23)22(19)26)28-13-4-12-27-16-6-8-17(9-7-16)29-14-21(24)25/h6-11,26H,3-5,12-14H2,1-2H3,(H,24,25) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
DrugBank
MCE
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.82E+3 | n/a | n/a | n/a | n/a |
Université d'Orléans
Curated by ChEMBL
| Assay Description
Activity at PPARgamma by luciferase reporter gene transactivation assay in COS7 cells |
Bioorg Med Chem Lett 16: 4528-32 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.028
BindingDB Entry DOI: 10.7270/Q28915HC |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50189965
(CHEMBL211963 | methyl 2-(4-(3-(2-propyl-4-(trifluo...)Show SMILES CCCc1cc(ccc1OCCCOc1ccc(OCC(=O)OC)cc1)C(F)(F)F Show InChI InChI=1S/C22H25F3O5/c1-3-5-16-14-17(22(23,24)25)6-11-20(16)29-13-4-12-28-18-7-9-19(10-8-18)30-15-21(26)27-2/h6-11,14H,3-5,12-13,15H2,1-2H3 | PDB
UniProtKB/SwissProt
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 |
Université d'Orléans
Curated by ChEMBL
| Assay Description
Activity at PPARalpha by luciferase reporter gene transactivation assay in COS7 cells |
Bioorg Med Chem Lett 16: 4528-32 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.028
BindingDB Entry DOI: 10.7270/Q28915HC |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50189964
(CHEMBL214394 | methyl 2-(2-methyl-4-(3-(2-propyl-4...)Show SMILES CCCc1cc(ccc1OCCCOc1ccc(OCC(=O)OC)c(C)c1)C(F)(F)F Show InChI InChI=1S/C23H27F3O5/c1-4-6-17-14-18(23(24,25)26)7-9-21(17)30-12-5-11-29-19-8-10-20(16(2)13-19)31-15-22(27)28-3/h7-10,13-14H,4-6,11-12,15H2,1-3H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 16 | n/a | n/a | n/a | n/a |
Université d'Orléans
Curated by ChEMBL
| Assay Description
Activity at PPARbeta/delta by luciferase reporter gene transactivation assay in COS7 cells |
Bioorg Med Chem Lett 16: 4528-32 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.028
BindingDB Entry DOI: 10.7270/Q28915HC |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50189965
(CHEMBL211963 | methyl 2-(4-(3-(2-propyl-4-(trifluo...)Show SMILES CCCc1cc(ccc1OCCCOc1ccc(OCC(=O)OC)cc1)C(F)(F)F Show InChI InChI=1S/C22H25F3O5/c1-3-5-16-14-17(22(23,24)25)6-11-20(16)29-13-4-12-28-18-7-9-19(10-8-18)30-15-21(26)27-2/h6-11,14H,3-5,12-13,15H2,1-2H3 | 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 | 1.19E+3 | n/a | n/a | n/a | n/a |
Université d'Orléans
Curated by ChEMBL
| Assay Description
Activity at PPARgamma by luciferase reporter gene transactivation assay in COS7 cells |
Bioorg Med Chem Lett 16: 4528-32 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.028
BindingDB Entry DOI: 10.7270/Q28915HC |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50085041
(2-(4-(3-(4-acetyl-3-hydroxy-2-propylphenoxy)propox...)Show SMILES CCCc1c(O)c(ccc1OCCCOc1ccc(OCC(O)=O)cc1)C(C)=O Show InChI InChI=1S/C22H26O7/c1-3-5-19-20(11-10-18(15(2)23)22(19)26)28-13-4-12-27-16-6-8-17(9-7-16)29-14-21(24)25/h6-11,26H,3-5,12-14H2,1-2H3,(H,24,25) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
DrugBank
MCE
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 977 | n/a | n/a | n/a | n/a |
Université d'Orléans
Curated by ChEMBL
| Assay Description
Activity at PPARalpha by luciferase reporter gene transactivation assay in COS7 cells |
Bioorg Med Chem Lett 16: 4528-32 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.028
BindingDB Entry DOI: 10.7270/Q28915HC |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50189970
(CHEMBL373785 | methyl 2-(4-(3-(4-acetyl-3-hydroxy-...)Show SMILES CCCc1c(O)c(ccc1OCCCOc1ccc(OCC(=O)OC)cc1)C(C)=O Show InChI InChI=1S/C23H28O7/c1-4-6-20-21(12-11-19(16(2)24)23(20)26)29-14-5-13-28-17-7-9-18(10-8-17)30-15-22(25)27-3/h7-12,26H,4-6,13-15H2,1-3H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 288 | n/a | n/a | n/a | n/a |
Université d'Orléans
Curated by ChEMBL
| Assay Description
Activity at PPARgamma by luciferase reporter gene transactivation assay in COS7 cells |
Bioorg Med Chem Lett 16: 4528-32 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.028
BindingDB Entry DOI: 10.7270/Q28915HC |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50189967
(2-(2-methyl-4-(3-(4-propyl-6-(trifluoromethyl)pyri...)Show SMILES CCCc1cc(ncc1OCCCOc1ccc(OCC(O)=O)c(C)c1)C(F)(F)F Show InChI InChI=1S/C21H24F3NO5/c1-3-5-15-11-19(21(22,23)24)25-12-18(15)29-9-4-8-28-16-6-7-17(14(2)10-16)30-13-20(26)27/h6-7,10-12H,3-5,8-9,13H2,1-2H3,(H,26,27) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.33E+3 | n/a | n/a | n/a | n/a |
Université d'Orléans
Curated by ChEMBL
| Assay Description
Activity at PPARalpha by luciferase reporter gene transactivation assay in COS7 cells |
Bioorg Med Chem Lett 16: 4528-32 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.028
BindingDB Entry DOI: 10.7270/Q28915HC |
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
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MCE
PC cid
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PDB
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| Article
PubMed
| n/a | n/a | n/a | n/a | 1.00E+4 | n/a | n/a | n/a | n/a |
Université d'Orléans
Curated by ChEMBL
| Assay Description
Activity at PPARalpha by luciferase reporter gene transactivation assay in COS7 cells |
Bioorg Med Chem Lett 16: 4528-32 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.028
BindingDB Entry DOI: 10.7270/Q28915HC |
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
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| Purchase
CHEMBL
DrugBank
MCE
PC cid
PC sid
PDB
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.00E+4 | n/a | n/a | n/a | n/a |
Université d'Orléans
Curated by ChEMBL
| Assay Description
Activity at PPARgamma by luciferase reporter gene transactivation assay in COS7 cells |
Bioorg Med Chem Lett 16: 4528-32 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.028
BindingDB Entry DOI: 10.7270/Q28915HC |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50189970
(CHEMBL373785 | methyl 2-(4-(3-(4-acetyl-3-hydroxy-...)Show SMILES CCCc1c(O)c(ccc1OCCCOc1ccc(OCC(=O)OC)cc1)C(C)=O Show InChI InChI=1S/C23H28O7/c1-4-6-20-21(12-11-19(16(2)24)23(20)26)29-14-5-13-28-17-7-9-18(10-8-17)30-15-22(25)27-3/h7-12,26H,4-6,13-15H2,1-3H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
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CHEMBL
PC cid
PC sid
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| Article
PubMed
| n/a | n/a | n/a | n/a | 1.07E+3 | n/a | n/a | n/a | n/a |
Université d'Orléans
Curated by ChEMBL
| Assay Description
Activity at PPARalpha by luciferase reporter gene transactivation assay in COS7 cells |
Bioorg Med Chem Lett 16: 4528-32 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.028
BindingDB Entry DOI: 10.7270/Q28915HC |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50189967
(2-(2-methyl-4-(3-(4-propyl-6-(trifluoromethyl)pyri...)Show SMILES CCCc1cc(ncc1OCCCOc1ccc(OCC(O)=O)c(C)c1)C(F)(F)F Show InChI InChI=1S/C21H24F3NO5/c1-3-5-15-11-19(21(22,23)24)25-12-18(15)29-9-4-8-28-16-6-7-17(14(2)10-16)30-13-20(26)27/h6-7,10-12H,3-5,8-9,13H2,1-2H3,(H,26,27) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.58E+3 | n/a | n/a | n/a | n/a |
Université d'Orléans
Curated by ChEMBL
| Assay Description
Activity at PPARgamma by luciferase reporter gene transactivation assay in COS7 cells |
Bioorg Med Chem Lett 16: 4528-32 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.028
BindingDB Entry DOI: 10.7270/Q28915HC |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50189966
(2-(2-methyl-4-(3-(2-propyl-4-(trifluoromethyl)phen...)Show SMILES CCCc1cc(ccc1OCCCOc1ccc(OCC(O)=O)c(C)c1)C(F)(F)F Show InChI InChI=1S/C22H25F3O5/c1-3-5-16-13-17(22(23,24)25)6-8-20(16)29-11-4-10-28-18-7-9-19(15(2)12-18)30-14-21(26)27/h6-9,12-13H,3-5,10-11,14H2,1-2H3,(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 | 103 | n/a | n/a | n/a | n/a |
Université d'Orléans
Curated by ChEMBL
| Assay Description
Activity at PPARalpha by luciferase reporter gene transactivation assay in COS7 cells |
Bioorg Med Chem Lett 16: 4528-32 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.028
BindingDB Entry DOI: 10.7270/Q28915HC |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50189970
(CHEMBL373785 | methyl 2-(4-(3-(4-acetyl-3-hydroxy-...)Show SMILES CCCc1c(O)c(ccc1OCCCOc1ccc(OCC(=O)OC)cc1)C(C)=O Show InChI InChI=1S/C23H28O7/c1-4-6-20-21(12-11-19(16(2)24)23(20)26)29-14-5-13-28-17-7-9-18(10-8-17)30-15-22(25)27-3/h7-12,26H,4-6,13-15H2,1-3H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 457 | n/a | n/a | n/a | n/a |
Université d'Orléans
Curated by ChEMBL
| Assay Description
Activity at PPARbeta/delta by luciferase reporter gene transactivation assay in COS7 cells |
Bioorg Med Chem Lett 16: 4528-32 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.028
BindingDB Entry DOI: 10.7270/Q28915HC |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50189965
(CHEMBL211963 | methyl 2-(4-(3-(2-propyl-4-(trifluo...)Show SMILES CCCc1cc(ccc1OCCCOc1ccc(OCC(=O)OC)cc1)C(F)(F)F Show InChI InChI=1S/C22H25F3O5/c1-3-5-16-14-17(22(23,24)25)6-11-20(16)29-13-4-12-28-18-7-9-19(10-8-18)30-15-21(26)27-2/h6-11,14H,3-5,12-13,15H2,1-2H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 98 | n/a | n/a | n/a | n/a |
Université d'Orléans
Curated by ChEMBL
| Assay Description
Activity at PPARbeta/delta by luciferase reporter gene transactivation assay in COS7 cells |
Bioorg Med Chem Lett 16: 4528-32 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.028
BindingDB Entry DOI: 10.7270/Q28915HC |
More data for this
Ligand-Target Pair | |
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