Found 98 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)) | BDBM50244361
(CHEMBL4094877)Show SMILES OC(=O)CCCc1cc2cc(Cl)ccc2n1S(=O)(=O)c1ccccc1 Show InChI InChI=1S/C18H16ClNO4S/c19-14-9-10-17-13(11-14)12-15(5-4-8-18(21)22)20(17)25(23,24)16-6-2-1-3-7-16/h1-3,6-7,9-12H,4-5,8H2,(H,21,22) | 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 | 284 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARgamma LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50244324
(CHEMBL4081907)Show SMILES COc1cccc(c1)S(=O)(=O)n1c(CCCC(O)=O)cc2cc(ccc12)C(F)(F)F Show InChI InChI=1S/C20H18F3NO5S/c1-29-16-5-3-6-17(12-16)30(27,28)24-15(4-2-7-19(25)26)11-13-10-14(20(21,22)23)8-9-18(13)24/h3,5-6,8-12H,2,4,7H2,1H3,(H,25,26) | 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 | 65 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARgamma LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50244362
(CHEMBL4089775)Show SMILES COc1ccccc1S(=O)(=O)n1c(CCCC(O)=O)cc2cc(ccc12)C(F)(F)F Show InChI InChI=1S/C20H18F3NO5S/c1-29-17-6-2-3-7-18(17)30(27,28)24-15(5-4-8-19(25)26)12-13-11-14(20(21,22)23)9-10-16(13)24/h2-3,6-7,9-12H,4-5,8H2,1H3,(H,25,26) | 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 | 1.25E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARgamma LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50244347
(CHEMBL4073181)Show SMILES Cc1cccc(c1)S(=O)(=O)n1c(CCCC(O)=O)cc2cc(Cl)ccc12 Show InChI InChI=1S/C19H18ClNO4S/c1-13-4-2-6-17(10-13)26(24,25)21-16(5-3-7-19(22)23)12-14-11-15(20)8-9-18(14)21/h2,4,6,8-12H,3,5,7H2,1H3,(H,22,23) | 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 | 75 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARgamma LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Mus musculus) | BDBM50244350
(CHEMBL4091374)Show SMILES OC(=O)CCCc1cc2cc(Cl)ccc2n1S(=O)(=O)c1ccc2ncsc2c1 Show InChI InChI=1S/C19H15ClN2O4S2/c20-13-4-7-17-12(8-13)9-14(2-1-3-19(23)24)22(17)28(25,26)15-5-6-16-18(10-15)27-11-21-16/h4-11H,1-3H2,(H,23,24) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
PDB
UniChem
Similars
| PDB
Article
PubMed
| n/a | n/a | n/a | n/a | 366 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of mouse GAL4-fused PPARalpha LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50244349
(CHEMBL4101596)Show SMILES OC(=O)CCCc1cc2cc(Cl)ccc2n1S(=O)(=O)c1ccc2OCOc2c1 Show InChI InChI=1S/C19H16ClNO6S/c20-13-4-6-16-12(8-13)9-14(2-1-3-19(22)23)21(16)28(24,25)15-5-7-17-18(10-15)27-11-26-17/h4-10H,1-3,11H2,(H,22,23) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 790 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARalpha LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50244348
(CHEMBL4083589)Show SMILES CN1CCOc2ccc(cc12)S(=O)(=O)n1c(CCCC(O)=O)cc2cc(Cl)ccc12 Show InChI InChI=1S/C21H21ClN2O5S/c1-23-9-10-29-20-8-6-17(13-19(20)23)30(27,28)24-16(3-2-4-21(25)26)12-14-11-15(22)5-7-18(14)24/h5-8,11-13H,2-4,9-10H2,1H3,(H,25,26) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 410 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARalpha LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50244324
(CHEMBL4081907)Show SMILES COc1cccc(c1)S(=O)(=O)n1c(CCCC(O)=O)cc2cc(ccc12)C(F)(F)F Show InChI InChI=1S/C20H18F3NO5S/c1-29-16-5-3-6-17(12-16)30(27,28)24-15(4-2-7-19(25)26)11-13-10-14(20(21,22)23)8-9-18(13)24/h3,5-6,8-12H,2,4,7H2,1H3,(H,25,26) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.16E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARalpha LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50244312
(CHEMBL4074391)Show InChI InChI=1S/C17H14ClNO4S/c18-13-6-8-16-12(10-13)11-14(7-9-17(20)21)19(16)24(22,23)15-4-2-1-3-5-15/h1-6,8,10-11H,7,9H2,(H,20,21) | 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 |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARalpha LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50244397
(CHEMBL4104907)Show SMILES Nc1nc2ccc(cc2s1)S(=O)(=O)n1c(CCCC(O)=O)cc2cc(Cl)ccc12 Show InChI InChI=1S/C19H16ClN3O4S2/c20-12-4-7-16-11(8-12)9-13(2-1-3-18(24)25)23(16)29(26,27)14-5-6-15-17(10-14)28-19(21)22-15/h4-10H,1-3H2,(H2,21,22)(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 | 1.26E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARalpha LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50244426
(CHEMBL4088168)Show SMILES OC(=O)CCCc1cc2cc(Cl)ccc2n1S(=O)(=O)c1ccc2nsnc2c1 Show InChI InChI=1S/C18H14ClN3O4S2/c19-12-4-7-17-11(8-12)9-13(2-1-3-18(23)24)22(17)28(25,26)14-5-6-15-16(10-14)21-27-20-15/h4-10H,1-3H2,(H,23,24) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | >5.00E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARalpha LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50244326
(CHEMBL4062724)Show SMILES OC(=O)CCCc1cc2cc(ccc2n1S(=O)(=O)c1ccc(Cl)cc1)C(F)(F)F Show InChI InChI=1S/C19H15ClF3NO4S/c20-14-5-7-16(8-6-14)29(27,28)24-15(2-1-3-18(25)26)11-12-10-13(19(21,22)23)4-9-17(12)24/h4-11H,1-3H2,(H,25,26) | 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 | 629 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARgamma LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50244348
(CHEMBL4083589)Show SMILES CN1CCOc2ccc(cc12)S(=O)(=O)n1c(CCCC(O)=O)cc2cc(Cl)ccc12 Show InChI InChI=1S/C21H21ClN2O5S/c1-23-9-10-29-20-8-6-17(13-19(20)23)30(27,28)24-16(3-2-4-21(25)26)12-14-11-15(22)5-7-18(14)24/h5-8,11-13H,2-4,9-10H2,1H3,(H,25,26) | 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 | 16 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARgamma LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50244431
(CHEMBL4063529)Show SMILES OC(=O)CCCc1cc2cc(Cl)ccc2n1S(=O)(=O)c1ccc2ccccc2c1 Show InChI InChI=1S/C22H18ClNO4S/c23-18-9-11-21-17(12-18)13-19(6-3-7-22(25)26)24(21)29(27,28)20-10-8-15-4-1-2-5-16(15)14-20/h1-2,4-5,8-14H,3,6-7H2,(H,25,26) | 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 |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARgamma LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50244432
(CHEMBL4103575)Show SMILES CC(C)(CCc1cc2cc(Cl)ccc2n1S(=O)(=O)c1ccccc1)C(O)=O Show InChI InChI=1S/C20H20ClNO4S/c1-20(2,19(23)24)11-10-16-13-14-12-15(21)8-9-18(14)22(16)27(25,26)17-6-4-3-5-7-17/h3-9,12-13H,10-11H2,1-2H3,(H,23,24) | PDB
UniProtKB/SwissProt
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 |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARalpha LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50030474
(Avandamet | Avandaryl | Avandia | BRL-49653 | CHEB...)Show InChI InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
DrugBank
MCE
PC cid
PC sid
PDB
UniChem
Similars
| DrugBank
PDB
Article
PubMed
| n/a | n/a | n/a | n/a | 114 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of recombinant GST-tagged PPARgamma (unknown origin) expressed in Escherichia coli assessed as N-terminal biotin-labeled NCoA3 (607 t... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50244364
(CHEMBL4071373)Show SMILES OC(=O)CCCc1cc2cc(ccc2n1S(=O)(=O)c1cccc(OC(F)(F)F)c1)C(F)(F)F Show InChI InChI=1S/C20H15F6NO5S/c21-19(22,23)13-7-8-17-12(9-13)10-14(3-1-6-18(28)29)27(17)33(30,31)16-5-2-4-15(11-16)32-20(24,25)26/h2,4-5,7-11H,1,3,6H2,(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 | 1.14E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARdelta LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50244347
(CHEMBL4073181)Show SMILES Cc1cccc(c1)S(=O)(=O)n1c(CCCC(O)=O)cc2cc(Cl)ccc12 Show InChI InChI=1S/C19H18ClNO4S/c1-13-4-2-6-17(10-13)26(24,25)21-16(5-3-7-19(22)23)12-14-11-15(20)8-9-18(14)21/h2,4,6,8-12H,3,5,7H2,1H3,(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 | 1.35E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARdelta LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50244349
(CHEMBL4101596)Show SMILES OC(=O)CCCc1cc2cc(Cl)ccc2n1S(=O)(=O)c1ccc2OCOc2c1 Show InChI InChI=1S/C19H16ClNO6S/c20-13-4-6-16-12(8-13)9-14(2-1-3-19(22)23)21(16)28(24,25)15-5-7-17-18(10-15)27-11-26-17/h4-10H,1-3,11H2,(H,22,23) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 977 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARdelta LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50244325
(CHEMBL4067479)Show SMILES OC(=O)CCCc1cc2cc(ccc2n1S(=O)(=O)c1cccc(Cl)c1)C(F)(F)F Show InChI InChI=1S/C19H15ClF3NO4S/c20-14-3-1-5-16(11-14)29(27,28)24-15(4-2-6-18(25)26)10-12-9-13(19(21,22)23)7-8-17(12)24/h1,3,5,7-11H,2,4,6H2,(H,25,26) | 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 | 256 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARgamma LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50244364
(CHEMBL4071373)Show SMILES OC(=O)CCCc1cc2cc(ccc2n1S(=O)(=O)c1cccc(OC(F)(F)F)c1)C(F)(F)F Show InChI InChI=1S/C20H15F6NO5S/c21-19(22,23)13-7-8-17-12(9-13)10-14(3-1-6-18(28)29)27(17)33(30,31)16-5-2-4-15(11-16)32-20(24,25)26/h2,4-5,7-11H,1,3,6H2,(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 | 201 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARgamma LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50244395
(CHEMBL4072143)Show SMILES Cc1nc2ccc(cc2s1)S(=O)(=O)n1c(CCCC(O)=O)cc2cc(Cl)ccc12 Show InChI InChI=1S/C20H17ClN2O4S2/c1-12-22-17-7-6-16(11-19(17)28-12)29(26,27)23-15(3-2-4-20(24)25)10-13-9-14(21)5-8-18(13)23/h5-11H,2-4H2,1H3,(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 | 11 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARgamma LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50244397
(CHEMBL4104907)Show SMILES Nc1nc2ccc(cc2s1)S(=O)(=O)n1c(CCCC(O)=O)cc2cc(Cl)ccc12 Show InChI InChI=1S/C19H16ClN3O4S2/c20-12-4-7-16-11(8-12)9-13(2-1-3-18(24)25)23(16)29(26,27)14-5-6-15-17(10-14)28-19(21)22-15/h4-10H,1-3H2,(H2,21,22)(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 | 919 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARdelta LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50244426
(CHEMBL4088168)Show SMILES OC(=O)CCCc1cc2cc(Cl)ccc2n1S(=O)(=O)c1ccc2nsnc2c1 Show InChI InChI=1S/C18H14ClN3O4S2/c19-12-4-7-17-11(8-12)9-13(2-1-3-18(23)24)22(17)28(25,26)14-5-6-15-16(10-14)21-27-20-15/h4-10H,1-3H2,(H,23,24) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | >5.00E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARdelta LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50244396
(CHEMBL4087052)Show SMILES Cc1nc2cc(ccc2s1)S(=O)(=O)n1c(CCCC(O)=O)cc2cc(Cl)ccc12 Show InChI InChI=1S/C20H17ClN2O4S2/c1-12-22-17-11-16(6-8-19(17)28-12)29(26,27)23-15(3-2-4-20(24)25)10-13-9-14(21)5-7-18(13)23/h5-11H,2-4H2,1H3,(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 | 175 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARgamma LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50244428
(CHEMBL4075456)Show SMILES OC(=O)CCCc1cc2cc(Cl)ccc2n1S(=O)(=O)c1ccc2nc[nH]c2c1 Show InChI InChI=1S/C19H16ClN3O4S/c20-13-4-7-18-12(8-13)9-14(2-1-3-19(24)25)23(18)28(26,27)15-5-6-16-17(10-15)22-11-21-16/h4-11H,1-3H2,(H,21,22)(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 | >5.00E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARgamma LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50244350
(CHEMBL4091374)Show SMILES OC(=O)CCCc1cc2cc(Cl)ccc2n1S(=O)(=O)c1ccc2ncsc2c1 Show InChI InChI=1S/C19H15ClN2O4S2/c20-13-4-7-17-12(8-13)9-14(2-1-3-19(23)24)22(17)28(25,26)15-5-6-16-18(10-15)27-11-21-16/h4-11H,1-3H2,(H,23,24) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
PDB
UniChem
Similars
| PDB
Article
PubMed
| n/a | n/a | n/a | n/a | 4.10E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Displacement of N-terminal biotin-labeled NCOR-ID1 (2253 to 2277 residues) from recombinant GST-tagged PPARgamma (unknown origin) expressed in Escher... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Peroxisome proliferator-activated receptor gamma
(Mus musculus) | BDBM50244350
(CHEMBL4091374)Show SMILES OC(=O)CCCc1cc2cc(Cl)ccc2n1S(=O)(=O)c1ccc2ncsc2c1 Show InChI InChI=1S/C19H15ClN2O4S2/c20-13-4-7-17-12(8-13)9-14(2-1-3-19(23)24)22(17)28(25,26)15-5-6-16-18(10-15)27-11-21-16/h4-11H,1-3H2,(H,23,24) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
PDB
UniChem
Similars
| PDB
Article
PubMed
| n/a | n/a | n/a | n/a | 202 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of mouse GAL4-fused PPARgamma LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50244429
(CHEMBL4060007)Show SMILES COc1ccc(cc1)S(=O)(=O)n1c(CCCC(O)=O)cc2cc(ccc12)C(F)(F)F Show InChI InChI=1S/C20H18F3NO5S/c1-29-16-6-8-17(9-7-16)30(27,28)24-15(3-2-4-19(25)26)12-13-11-14(20(21,22)23)5-10-18(13)24/h5-12H,2-4H2,1H3,(H,25,26) | 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 | 82 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARgamma LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50244428
(CHEMBL4075456)Show SMILES OC(=O)CCCc1cc2cc(Cl)ccc2n1S(=O)(=O)c1ccc2nc[nH]c2c1 Show InChI InChI=1S/C19H16ClN3O4S/c20-13-4-7-18-12(8-13)9-14(2-1-3-19(24)25)23(18)28(26,27)15-5-6-16-17(10-15)22-11-21-16/h4-11H,1-3H2,(H,21,22)(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 | >5.00E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARdelta LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50244350
(CHEMBL4091374)Show SMILES OC(=O)CCCc1cc2cc(Cl)ccc2n1S(=O)(=O)c1ccc2ncsc2c1 Show InChI InChI=1S/C19H15ClN2O4S2/c20-13-4-7-17-12(8-13)9-14(2-1-3-19(23)24)22(17)28(25,26)15-5-6-16-18(10-15)27-11-21-16/h4-11H,1-3H2,(H,23,24) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
PDB
UniChem
Similars
| PDB
Article
PubMed
| n/a | n/a | n/a | n/a | 3.41E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of recombinant GST-tagged PPARgamma (unknown origin) expressed in Escherichia coli assessed as N-terminal biotin-labeled SRC1 (619 to... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50244393
(CHEMBL4093864)Show SMILES Cc1ccc(cc1)S(=O)(=O)n1c(CCCC(O)=O)cc2cc(Cl)ccc12 Show InChI InChI=1S/C19H18ClNO4S/c1-13-5-8-17(9-6-13)26(24,25)21-16(3-2-4-19(22)23)12-14-11-15(20)7-10-18(14)21/h5-12H,2-4H2,1H3,(H,22,23) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.09E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARdelta LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50244325
(CHEMBL4067479)Show SMILES OC(=O)CCCc1cc2cc(ccc2n1S(=O)(=O)c1cccc(Cl)c1)C(F)(F)F Show InChI InChI=1S/C19H15ClF3NO4S/c20-14-3-1-5-16(11-14)29(27,28)24-15(4-2-6-18(25)26)10-12-9-13(19(21,22)23)7-8-17(12)24/h1,3,5,7-11H,2,4,6H2,(H,25,26) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 2.03E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARdelta LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50244314
(CHEMBL4079308)Show SMILES OC(=O)CCCc1cc2cc(ccc2n1S(=O)(=O)c1ccccc1)C(F)(F)F Show InChI InChI=1S/C19H16F3NO4S/c20-19(21,22)14-9-10-17-13(11-14)12-15(5-4-8-18(24)25)23(17)28(26,27)16-6-2-1-3-7-16/h1-3,6-7,9-12H,4-5,8H2,(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 | 417 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARgamma LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50244345
(CHEMBL4098415)Show SMILES OC(=O)CCCc1cc2cc(ccc2n1S(=O)(=O)c1ccc(OC(F)(F)F)cc1)C(F)(F)F Show InChI InChI=1S/C20H15F6NO5S/c21-19(22,23)13-4-9-17-12(10-13)11-14(2-1-3-18(28)29)27(17)33(30,31)16-7-5-15(6-8-16)32-20(24,25)26/h4-11H,1-3H2,(H,28,29) | 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 | 573 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARgamma LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50244350
(CHEMBL4091374)Show SMILES OC(=O)CCCc1cc2cc(Cl)ccc2n1S(=O)(=O)c1ccc2ncsc2c1 Show InChI InChI=1S/C19H15ClN2O4S2/c20-13-4-7-17-12(8-13)9-14(2-1-3-19(23)24)22(17)28(25,26)15-5-6-16-18(10-15)27-11-21-16/h4-11H,1-3H2,(H,23,24) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
PDB
UniChem
Similars
| PDB
Article
PubMed
| n/a | n/a | n/a | n/a | 206 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARgamma LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50244350
(CHEMBL4091374)Show SMILES OC(=O)CCCc1cc2cc(Cl)ccc2n1S(=O)(=O)c1ccc2ncsc2c1 Show InChI InChI=1S/C19H15ClN2O4S2/c20-13-4-7-17-12(8-13)9-14(2-1-3-19(23)24)22(17)28(25,26)15-5-6-16-18(10-15)27-11-21-16/h4-11H,1-3H2,(H,23,24) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
PDB
UniChem
Similars
| PDB
Article
PubMed
| n/a | n/a | n/a | n/a | 1.14E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Displacement of N-terminal biotin-labeled SMRT-ID1 (2339 to 2363 residues) from recombinant GST-tagged PPARgamma (unknown origin) expressed in Escher... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50244350
(CHEMBL4091374)Show SMILES OC(=O)CCCc1cc2cc(Cl)ccc2n1S(=O)(=O)c1ccc2ncsc2c1 Show InChI InChI=1S/C19H15ClN2O4S2/c20-13-4-7-17-12(8-13)9-14(2-1-3-19(23)24)22(17)28(25,26)15-5-6-16-18(10-15)27-11-21-16/h4-11H,1-3H2,(H,23,24) | PDB
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Article
PubMed
| n/a | n/a | n/a | n/a | 1.54E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARalpha LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50244364
(CHEMBL4071373)Show SMILES OC(=O)CCCc1cc2cc(ccc2n1S(=O)(=O)c1cccc(OC(F)(F)F)c1)C(F)(F)F Show InChI InChI=1S/C20H15F6NO5S/c21-19(22,23)13-7-8-17-12(9-13)10-14(3-1-6-18(28)29)27(17)33(30,31)16-5-2-4-15(11-16)32-20(24,25)26/h2,4-5,7-11H,1,3,6H2,(H,28,29) | PDB
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UniChem
Similars
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PubMed
| n/a | n/a | n/a | n/a | 2.76E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARalpha LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50244362
(CHEMBL4089775)Show SMILES COc1ccccc1S(=O)(=O)n1c(CCCC(O)=O)cc2cc(ccc12)C(F)(F)F Show InChI InChI=1S/C20H18F3NO5S/c1-29-17-6-2-3-7-18(17)30(27,28)24-15(5-4-8-19(25)26)12-13-11-14(20(21,22)23)9-10-16(13)24/h2-3,6-7,9-12H,4-5,8H2,1H3,(H,25,26) | PDB
UniProtKB/SwissProt
antibodypedia
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PubMed
| n/a | n/a | n/a | n/a | >5.00E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARalpha LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50244315
(CHEMBL4095821)Show SMILES Cc1ccc2n(c(CCCC(O)=O)cc2c1)S(=O)(=O)c1ccccc1 Show InChI InChI=1S/C19H19NO4S/c1-14-10-11-18-15(12-14)13-16(6-5-9-19(21)22)20(18)25(23,24)17-7-3-2-4-8-17/h2-4,7-8,10-13H,5-6,9H2,1H3,(H,21,22) | PDB
UniProtKB/SwissProt
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UniChem
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PubMed
| n/a | n/a | n/a | n/a | 1.30E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARalpha LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50244361
(CHEMBL4094877)Show SMILES OC(=O)CCCc1cc2cc(Cl)ccc2n1S(=O)(=O)c1ccccc1 Show InChI InChI=1S/C18H16ClNO4S/c19-14-9-10-17-13(11-14)12-15(5-4-8-18(21)22)20(17)25(23,24)16-6-2-1-3-7-16/h1-3,6-7,9-12H,4-5,8H2,(H,21,22) | PDB
UniProtKB/SwissProt
antibodypedia
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UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 956 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARalpha LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50244394
(CHEMBL4062472)Show SMILES OC(=O)CCCc1cc2cc(Cl)ccc2n1S(=O)(=O)c1cccc2ccccc12 Show InChI InChI=1S/C22H18ClNO4S/c23-17-11-12-20-16(13-17)14-18(7-4-10-22(25)26)24(20)29(27,28)21-9-3-6-15-5-1-2-8-19(15)21/h1-3,5-6,8-9,11-14H,4,7,10H2,(H,25,26) | PDB
UniProtKB/SwissProt
antibodypedia
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PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 901 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARalpha LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50244345
(CHEMBL4098415)Show SMILES OC(=O)CCCc1cc2cc(ccc2n1S(=O)(=O)c1ccc(OC(F)(F)F)cc1)C(F)(F)F Show InChI InChI=1S/C20H15F6NO5S/c21-19(22,23)13-4-9-17-12(10-13)11-14(2-1-3-18(28)29)27(17)33(30,31)16-7-5-15(6-8-16)32-20(24,25)26/h4-11H,1-3H2,(H,28,29) | PDB
UniProtKB/SwissProt
antibodypedia
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UniChem
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Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 2.10E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARdelta LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50244346
(CHEMBL4093146)Show SMILES COc1cccc(c1)S(=O)(=O)n1c(CCCC(O)=O)cc2cc(Cl)ccc12 Show InChI InChI=1S/C19H18ClNO5S/c1-26-16-5-3-6-17(12-16)27(24,25)21-15(4-2-7-19(22)23)11-13-10-14(20)8-9-18(13)21/h3,5-6,8-12H,2,4,7H2,1H3,(H,22,23) | PDB
UniProtKB/SwissProt
antibodypedia
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UniChem
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| Article
PubMed
| n/a | n/a | n/a | n/a | 1.23E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARdelta LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50244363
(CHEMBL4090691)Show SMILES OC(=O)CCCc1cc2cc(ccc2n1S(=O)(=O)c1ccccc1Cl)C(F)(F)F Show InChI InChI=1S/C19H15ClF3NO4S/c20-15-5-1-2-6-17(15)29(27,28)24-14(4-3-7-18(25)26)11-12-10-13(19(21,22)23)8-9-16(12)24/h1-2,5-6,8-11H,3-4,7H2,(H,25,26) | 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 | >5.00E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARgamma LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50244394
(CHEMBL4062472)Show SMILES OC(=O)CCCc1cc2cc(Cl)ccc2n1S(=O)(=O)c1cccc2ccccc12 Show InChI InChI=1S/C22H18ClNO4S/c23-17-11-12-20-16(13-17)14-18(7-4-10-22(25)26)24(20)29(27,28)21-9-3-6-15-5-1-2-8-19(15)21/h1-3,5-6,8-9,11-14H,4,7,10H2,(H,25,26) | 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 | 265 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARgamma LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50030474
(Avandamet | Avandaryl | Avandia | BRL-49653 | CHEB...)Show InChI InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
DrugBank
MCE
PC cid
PC sid
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UniChem
Similars
| DrugBank
PDB
Article
PubMed
| n/a | n/a | n/a | n/a | 95 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Displacement of N-terminal biotin-labeled SMRT-ID1 (2339 to 2363 residues) from recombinant GST-tagged PPARgamma (unknown origin) expressed in Escher... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50030474
(Avandamet | Avandaryl | Avandia | BRL-49653 | CHEB...)Show InChI InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
DrugBank
MCE
PC cid
PC sid
PDB
UniChem
Similars
| DrugBank
PDB
Article
PubMed
| n/a | n/a | n/a | n/a | 117 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of recombinant GST-tagged PPARgamma (unknown origin) expressed in Escherichia coli assessed as N-terminal biotin-labeled NCoA3 (671 t... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50244325
(CHEMBL4067479)Show SMILES OC(=O)CCCc1cc2cc(ccc2n1S(=O)(=O)c1cccc(Cl)c1)C(F)(F)F Show InChI InChI=1S/C19H15ClF3NO4S/c20-14-3-1-5-16(11-14)29(27,28)24-15(4-2-6-18(25)26)10-12-9-13(19(21,22)23)7-8-17(12)24/h1,3,5,7-11H,2,4,6H2,(H,25,26) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 2.42E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARalpha LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50244428
(CHEMBL4075456)Show SMILES OC(=O)CCCc1cc2cc(Cl)ccc2n1S(=O)(=O)c1ccc2nc[nH]c2c1 Show InChI InChI=1S/C19H16ClN3O4S/c20-13-4-7-18-12(8-13)9-14(2-1-3-19(24)25)23(18)28(26,27)15-5-6-16-17(10-15)22-11-21-16/h4-11H,1-3H2,(H,21,22)(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 | >5.00E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARalpha LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50244395
(CHEMBL4072143)Show SMILES Cc1nc2ccc(cc2s1)S(=O)(=O)n1c(CCCC(O)=O)cc2cc(Cl)ccc12 Show InChI InChI=1S/C20H17ClN2O4S2/c1-12-22-17-7-6-16(11-19(17)28-12)29(26,27)23-15(3-2-4-20(24)25)10-13-9-14(21)5-8-18(13)23/h5-11H,2-4H2,1H3,(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 | 441 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARdelta LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50244361
(CHEMBL4094877)Show SMILES OC(=O)CCCc1cc2cc(Cl)ccc2n1S(=O)(=O)c1ccccc1 Show InChI InChI=1S/C18H16ClNO4S/c19-14-9-10-17-13(11-14)12-15(5-4-8-18(21)22)20(17)25(23,24)16-6-2-1-3-7-16/h1-3,6-7,9-12H,4-5,8H2,(H,21,22) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 645 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARdelta LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50244312
(CHEMBL4074391)Show InChI InChI=1S/C17H14ClNO4S/c18-13-6-8-16-12(10-13)11-14(7-9-17(20)21)19(16)24(22,23)15-4-2-1-3-5-15/h1-6,8,10-11H,7,9H2,(H,20,21) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.91E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARdelta LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50244324
(CHEMBL4081907)Show SMILES COc1cccc(c1)S(=O)(=O)n1c(CCCC(O)=O)cc2cc(ccc12)C(F)(F)F Show InChI InChI=1S/C20H18F3NO5S/c1-29-16-5-3-6-17(12-16)30(27,28)24-15(4-2-7-19(25)26)11-13-10-14(20(21,22)23)8-9-18(13)24/h3,5-6,8-12H,2,4,7H2,1H3,(H,25,26) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.61E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARdelta LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50244348
(CHEMBL4083589)Show SMILES CN1CCOc2ccc(cc12)S(=O)(=O)n1c(CCCC(O)=O)cc2cc(Cl)ccc12 Show InChI InChI=1S/C21H21ClN2O5S/c1-23-9-10-29-20-8-6-17(13-19(20)23)30(27,28)24-16(3-2-4-21(25)26)12-14-11-15(22)5-7-18(14)24/h5-8,11-13H,2-4,9-10H2,1H3,(H,25,26) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 697 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARdelta LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50244350
(CHEMBL4091374)Show SMILES OC(=O)CCCc1cc2cc(Cl)ccc2n1S(=O)(=O)c1ccc2ncsc2c1 Show InChI InChI=1S/C19H15ClN2O4S2/c20-13-4-7-17-12(8-13)9-14(2-1-3-19(23)24)22(17)28(25,26)15-5-6-16-18(10-15)27-11-21-16/h4-11H,1-3H2,(H,23,24) | PDB
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PubMed
| n/a | n/a | n/a | n/a | 866 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARdelta LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50244392
(CHEMBL4072395)Show SMILES COc1ccc(cc1)S(=O)(=O)n1c(CCCC(O)=O)cc2cc(Cl)ccc12 Show InChI InChI=1S/C19H18ClNO5S/c1-26-16-6-8-17(9-7-16)27(24,25)21-15(3-2-4-19(22)23)12-13-11-14(20)5-10-18(13)21/h5-12H,2-4H2,1H3,(H,22,23) | 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 | 72 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARgamma LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50244349
(CHEMBL4101596)Show SMILES OC(=O)CCCc1cc2cc(Cl)ccc2n1S(=O)(=O)c1ccc2OCOc2c1 Show InChI InChI=1S/C19H16ClNO6S/c20-13-4-6-16-12(8-13)9-14(2-1-3-19(22)23)21(16)28(24,25)15-5-7-17-18(10-15)27-11-26-17/h4-10H,1-3,11H2,(H,22,23) | 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
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 71 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARgamma LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50244350
(CHEMBL4091374)Show SMILES OC(=O)CCCc1cc2cc(Cl)ccc2n1S(=O)(=O)c1ccc2ncsc2c1 Show InChI InChI=1S/C19H15ClN2O4S2/c20-13-4-7-17-12(8-13)9-14(2-1-3-19(23)24)22(17)28(25,26)15-5-6-16-18(10-15)27-11-21-16/h4-11H,1-3H2,(H,23,24) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
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| Purchase
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MCE
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| PDB
Article
PubMed
| n/a | n/a | n/a | n/a | 727 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of recombinant GST-tagged PPARgamma (unknown origin) expressed in Escherichia coli assessed as N-terminal biotin-labeled LCOR (39 to ... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50244350
(CHEMBL4091374)Show SMILES OC(=O)CCCc1cc2cc(Cl)ccc2n1S(=O)(=O)c1ccc2ncsc2c1 Show InChI InChI=1S/C19H15ClN2O4S2/c20-13-4-7-17-12(8-13)9-14(2-1-3-19(23)24)22(17)28(25,26)15-5-6-16-18(10-15)27-11-21-16/h4-11H,1-3H2,(H,23,24) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
PDB
UniChem
Similars
| PDB
Article
PubMed
| n/a | n/a | n/a | n/a | 1.48E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of recombinant GST-tagged PPARgamma (unknown origin) expressed in Escherichia coli assessed as N-terminal biotin-labeled NCoA3 (607 t... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50244350
(CHEMBL4091374)Show SMILES OC(=O)CCCc1cc2cc(Cl)ccc2n1S(=O)(=O)c1ccc2ncsc2c1 Show InChI InChI=1S/C19H15ClN2O4S2/c20-13-4-7-17-12(8-13)9-14(2-1-3-19(23)24)22(17)28(25,26)15-5-6-16-18(10-15)27-11-21-16/h4-11H,1-3H2,(H,23,24) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
PDB
UniChem
Similars
| PDB
Article
PubMed
| n/a | n/a | n/a | n/a | 1.92E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of recombinant GST-tagged PPARgamma (unknown origin) expressed in Escherichia coli assessed as N-terminal biotin-labeled NCoA3 (671 t... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50244347
(CHEMBL4073181)Show SMILES Cc1cccc(c1)S(=O)(=O)n1c(CCCC(O)=O)cc2cc(Cl)ccc12 Show InChI InChI=1S/C19H18ClNO4S/c1-13-4-2-6-17(10-13)26(24,25)21-16(5-3-7-19(22)23)12-14-11-15(20)8-9-18(14)21/h2,4,6,8-12H,3,5,7H2,1H3,(H,22,23) | PDB
UniProtKB/SwissProt
antibodypedia
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UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.25E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARalpha LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50244427
(CHEMBL4066889)Show SMILES OC(=O)CCCc1cc2cc(ccc2n1S(=O)(=O)c1ccc2scnc2c1)C(F)(F)F Show InChI InChI=1S/C20H15F3N2O4S2/c21-20(22,23)13-4-6-17-12(8-13)9-14(2-1-3-19(26)27)25(17)31(28,29)15-5-7-18-16(10-15)24-11-30-18/h4-11H,1-3H2,(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 | 1.62E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARalpha LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50244426
(CHEMBL4088168)Show SMILES OC(=O)CCCc1cc2cc(Cl)ccc2n1S(=O)(=O)c1ccc2nsnc2c1 Show InChI InChI=1S/C18H14ClN3O4S2/c19-12-4-7-17-11(8-12)9-13(2-1-3-18(23)24)22(17)28(25,26)14-5-6-15-16(10-14)21-27-20-15/h4-10H,1-3H2,(H,23,24) | 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 |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARgamma LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50244326
(CHEMBL4062724)Show SMILES OC(=O)CCCc1cc2cc(ccc2n1S(=O)(=O)c1ccc(Cl)cc1)C(F)(F)F Show InChI InChI=1S/C19H15ClF3NO4S/c20-14-5-7-16(8-6-14)29(27,28)24-15(2-1-3-18(25)26)11-12-10-13(19(21,22)23)4-9-17(12)24/h4-11H,1-3H2,(H,25,26) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 2.82E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARalpha LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50244429
(CHEMBL4060007)Show SMILES COc1ccc(cc1)S(=O)(=O)n1c(CCCC(O)=O)cc2cc(ccc12)C(F)(F)F Show InChI InChI=1S/C20H18F3NO5S/c1-29-16-6-8-17(9-7-16)30(27,28)24-15(3-2-4-19(25)26)12-13-11-14(20(21,22)23)5-10-18(13)24/h5-12H,2-4H2,1H3,(H,25,26) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 764 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARalpha LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50244396
(CHEMBL4087052)Show SMILES Cc1nc2cc(ccc2s1)S(=O)(=O)n1c(CCCC(O)=O)cc2cc(Cl)ccc12 Show InChI InChI=1S/C20H17ClN2O4S2/c1-12-22-17-11-16(6-8-19(17)28-12)29(26,27)23-15(3-2-4-20(24)25)10-13-9-14(21)5-7-18(13)23/h5-11H,2-4H2,1H3,(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 | 2.36E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARalpha LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50244396
(CHEMBL4087052)Show SMILES Cc1nc2cc(ccc2s1)S(=O)(=O)n1c(CCCC(O)=O)cc2cc(Cl)ccc12 Show InChI InChI=1S/C20H17ClN2O4S2/c1-12-22-17-11-16(6-8-19(17)28-12)29(26,27)23-15(3-2-4-20(24)25)10-13-9-14(21)5-7-18(13)23/h5-11H,2-4H2,1H3,(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 | 1.10E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARdelta LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50244427
(CHEMBL4066889)Show SMILES OC(=O)CCCc1cc2cc(ccc2n1S(=O)(=O)c1ccc2scnc2c1)C(F)(F)F Show InChI InChI=1S/C20H15F3N2O4S2/c21-20(22,23)13-4-6-17-12(8-13)9-14(2-1-3-19(26)27)25(17)31(28,29)15-5-7-18-16(10-15)24-11-30-18/h4-11H,1-3H2,(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 | 1.12E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARdelta LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50030474
(Avandamet | Avandaryl | Avandia | BRL-49653 | CHEB...)Show InChI InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
DrugBank
MCE
PC cid
PC sid
PDB
UniChem
Similars
| DrugBank
PDB
Article
PubMed
| n/a | n/a | n/a | n/a | 52 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of recombinant GST-tagged PPARgamma (unknown origin) expressed in Escherichia coli assessed as N-terminal biotin-labeled LCOR (39 to ... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50030474
(Avandamet | Avandaryl | Avandia | BRL-49653 | CHEB...)Show InChI InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
DrugBank
MCE
PC cid
PC sid
PDB
UniChem
Similars
| DrugBank
PDB
Article
PubMed
| n/a | n/a | n/a | n/a | 316 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of recombinant GST-tagged PPARgamma (unknown origin) expressed in Escherichia coli assessed as N-terminal biotin-labeled SRC1 (619 to... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50244392
(CHEMBL4072395)Show SMILES COc1ccc(cc1)S(=O)(=O)n1c(CCCC(O)=O)cc2cc(Cl)ccc12 Show InChI InChI=1S/C19H18ClNO5S/c1-26-16-6-8-17(9-7-16)27(24,25)21-15(3-2-4-19(22)23)12-13-11-14(20)5-10-18(13)21/h5-12H,2-4H2,1H3,(H,22,23) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 419 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARalpha LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50244314
(CHEMBL4079308)Show SMILES OC(=O)CCCc1cc2cc(ccc2n1S(=O)(=O)c1ccccc1)C(F)(F)F Show InChI InChI=1S/C19H16F3NO4S/c20-19(21,22)14-9-10-17-13(11-14)12-15(5-4-8-18(24)25)23(17)28(26,27)16-6-2-1-3-7-16/h1-3,6-7,9-12H,4-5,8H2,(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 | 1.20E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARalpha LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50244346
(CHEMBL4093146)Show SMILES COc1cccc(c1)S(=O)(=O)n1c(CCCC(O)=O)cc2cc(Cl)ccc12 Show InChI InChI=1S/C19H18ClNO5S/c1-26-16-5-3-6-17(12-16)27(24,25)21-15(4-2-7-19(22)23)11-13-10-14(20)8-9-18(13)21/h3,5-6,8-12H,2,4,7H2,1H3,(H,22,23) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
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UniChem
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| Article
PubMed
| n/a | n/a | n/a | n/a | 55 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARgamma LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50244393
(CHEMBL4093864)Show SMILES Cc1ccc(cc1)S(=O)(=O)n1c(CCCC(O)=O)cc2cc(Cl)ccc12 Show InChI InChI=1S/C19H18ClNO4S/c1-13-5-8-17(9-6-13)26(24,25)21-16(3-2-4-19(22)23)12-14-11-15(20)7-10-18(14)21/h5-12H,2-4H2,1H3,(H,22,23) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | >5.00E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARalpha LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50030474
(Avandamet | Avandaryl | Avandia | BRL-49653 | CHEB...)Show InChI InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
DrugBank
MCE
PC cid
PC sid
PDB
UniChem
Similars
| DrugBank
PDB
Article
PubMed
| n/a | n/a | n/a | n/a | 326 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Displacement of N-terminal biotin-labeled NCOR-ID1 (2253 to 2277 residues) from recombinant GST-tagged PPARgamma (unknown origin) expressed in Escher... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50244315
(CHEMBL4095821)Show SMILES Cc1ccc2n(c(CCCC(O)=O)cc2c1)S(=O)(=O)c1ccccc1 Show InChI InChI=1S/C19H19NO4S/c1-14-10-11-18-15(12-14)13-16(6-5-9-19(21)22)20(18)25(23,24)17-7-3-2-4-8-17/h2-4,7-8,10-13H,5-6,9H2,1H3,(H,21,22) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | >5.00E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARdelta LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50244315
(CHEMBL4095821)Show SMILES Cc1ccc2n(c(CCCC(O)=O)cc2c1)S(=O)(=O)c1ccccc1 Show InChI InChI=1S/C19H19NO4S/c1-14-10-11-18-15(12-14)13-16(6-5-9-19(21)22)20(18)25(23,24)17-7-3-2-4-8-17/h2-4,7-8,10-13H,5-6,9H2,1H3,(H,21,22) | 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 | 284 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARgamma LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50244420
(CHEMBL4095891)Show SMILES Nc1nc2ccc(cc2o1)S(=O)(=O)n1c(CCCC(O)=O)cc2cc(Cl)ccc12 Show InChI InChI=1S/C19H16ClN3O5S/c20-12-4-7-16-11(8-12)9-13(2-1-3-18(24)25)23(16)29(26,27)14-5-6-15-17(10-14)28-19(21)22-15/h4-10H,1-3H2,(H2,21,22)(H,24,25) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.39E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARdelta LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50244350
(CHEMBL4091374)Show SMILES OC(=O)CCCc1cc2cc(Cl)ccc2n1S(=O)(=O)c1ccc2ncsc2c1 Show InChI InChI=1S/C19H15ClN2O4S2/c20-13-4-7-17-12(8-13)9-14(2-1-3-19(23)24)22(17)28(25,26)15-5-6-16-18(10-15)27-11-21-16/h4-11H,1-3H2,(H,23,24) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
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| Purchase
CHEMBL
MCE
PC cid
PC sid
PDB
UniChem
Similars
| PDB
Article
PubMed
| n/a | n/a | n/a | n/a | 3.21E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of recombinant GST-tagged PPARgamma (unknown origin) expressed in Escherichia coli assessed as N-terminal biotin-labeled PGC1alpha (1... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Peroxisome proliferator-activated receptor delta
(Mus musculus) | BDBM50244350
(CHEMBL4091374)Show SMILES OC(=O)CCCc1cc2cc(Cl)ccc2n1S(=O)(=O)c1ccc2ncsc2c1 Show InChI InChI=1S/C19H15ClN2O4S2/c20-13-4-7-17-12(8-13)9-14(2-1-3-19(23)24)22(17)28(25,26)15-5-6-16-18(10-15)27-11-21-16/h4-11H,1-3H2,(H,23,24) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
PDB
UniChem
Similars
| PDB
Article
PubMed
| n/a | n/a | n/a | n/a | 1.56E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of mouse GAL4-fused PPARdelta LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50244363
(CHEMBL4090691)Show SMILES OC(=O)CCCc1cc2cc(ccc2n1S(=O)(=O)c1ccccc1Cl)C(F)(F)F Show InChI InChI=1S/C19H15ClF3NO4S/c20-15-5-1-2-6-17(15)29(27,28)24-14(4-3-7-18(25)26)11-12-10-13(19(21,22)23)8-9-16(12)24/h1-2,5-6,8-11H,3-4,7H2,(H,25,26) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | >5.00E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARalpha LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50244420
(CHEMBL4095891)Show SMILES Nc1nc2ccc(cc2o1)S(=O)(=O)n1c(CCCC(O)=O)cc2cc(Cl)ccc12 Show InChI InChI=1S/C19H16ClN3O5S/c20-12-4-7-16-11(8-12)9-13(2-1-3-18(24)25)23(16)29(26,27)14-5-6-15-17(10-14)28-19(21)22-15/h4-10H,1-3H2,(H2,21,22)(H,24,25) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | >5.00E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARalpha LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50244397
(CHEMBL4104907)Show SMILES Nc1nc2ccc(cc2s1)S(=O)(=O)n1c(CCCC(O)=O)cc2cc(Cl)ccc12 Show InChI InChI=1S/C19H16ClN3O4S2/c20-12-4-7-16-11(8-12)9-13(2-1-3-18(24)25)23(16)29(26,27)14-5-6-15-17(10-14)28-19(21)22-15/h4-10H,1-3H2,(H2,21,22)(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 | 41 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARgamma LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50244346
(CHEMBL4093146)Show SMILES COc1cccc(c1)S(=O)(=O)n1c(CCCC(O)=O)cc2cc(Cl)ccc12 Show InChI InChI=1S/C19H18ClNO5S/c1-26-16-5-3-6-17(12-16)27(24,25)21-15(4-2-7-19(22)23)11-13-10-14(20)8-9-18(13)21/h3,5-6,8-12H,2,4,7H2,1H3,(H,22,23) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 305 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARalpha LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50030474
(Avandamet | Avandaryl | Avandia | BRL-49653 | CHEB...)Show InChI InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
DrugBank
MCE
PC cid
PC sid
PDB
UniChem
Similars
| DrugBank
PDB
Article
PubMed
| n/a | n/a | n/a | n/a | 332 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of recombinant GST-tagged PPARgamma (unknown origin) expressed in Escherichia coli assessed as N-terminal biotin-labeled PGC1alpha (1... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50244314
(CHEMBL4079308)Show SMILES OC(=O)CCCc1cc2cc(ccc2n1S(=O)(=O)c1ccccc1)C(F)(F)F Show InChI InChI=1S/C19H16F3NO4S/c20-19(21,22)14-9-10-17-13(11-14)12-15(5-4-8-18(24)25)23(17)28(26,27)16-6-2-1-3-7-16/h1-3,6-7,9-12H,4-5,8H2,(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 | >5.00E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARdelta LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50244326
(CHEMBL4062724)Show SMILES OC(=O)CCCc1cc2cc(ccc2n1S(=O)(=O)c1ccc(Cl)cc1)C(F)(F)F Show InChI InChI=1S/C19H15ClF3NO4S/c20-14-5-7-16(8-6-14)29(27,28)24-15(2-1-3-18(25)26)11-12-10-13(19(21,22)23)4-9-17(12)24/h4-11H,1-3H2,(H,25,26) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.65E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARdelta LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50244312
(CHEMBL4074391)Show InChI InChI=1S/C17H14ClNO4S/c18-13-6-8-16-12(10-13)11-14(7-9-17(20)21)19(16)24(22,23)15-4-2-1-3-5-15/h1-6,8,10-11H,7,9H2,(H,20,21) | 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 | 1.56E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARgamma LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50244393
(CHEMBL4093864)Show SMILES Cc1ccc(cc1)S(=O)(=O)n1c(CCCC(O)=O)cc2cc(Cl)ccc12 Show InChI InChI=1S/C19H18ClNO4S/c1-13-5-8-17(9-6-13)26(24,25)21-16(3-2-4-19(22)23)12-14-11-15(20)7-10-18(14)21/h5-12H,2-4H2,1H3,(H,22,23) | 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 | 277 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARgamma LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50244420
(CHEMBL4095891)Show SMILES Nc1nc2ccc(cc2o1)S(=O)(=O)n1c(CCCC(O)=O)cc2cc(Cl)ccc12 Show InChI InChI=1S/C19H16ClN3O5S/c20-12-4-7-16-11(8-12)9-13(2-1-3-18(24)25)23(16)29(26,27)14-5-6-15-17(10-14)28-19(21)22-15/h4-10H,1-3H2,(H2,21,22)(H,24,25) | 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 | 378 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARgamma LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50244427
(CHEMBL4066889)Show SMILES OC(=O)CCCc1cc2cc(ccc2n1S(=O)(=O)c1ccc2scnc2c1)C(F)(F)F Show InChI InChI=1S/C20H15F3N2O4S2/c21-20(22,23)13-4-6-17-12(8-13)9-14(2-1-3-19(26)27)25(17)31(28,29)15-5-7-18-16(10-15)24-11-30-18/h4-11H,1-3H2,(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 | 147 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARgamma LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50244350
(CHEMBL4091374)Show SMILES OC(=O)CCCc1cc2cc(Cl)ccc2n1S(=O)(=O)c1ccc2ncsc2c1 Show InChI InChI=1S/C19H15ClN2O4S2/c20-13-4-7-17-12(8-13)9-14(2-1-3-19(23)24)22(17)28(25,26)15-5-6-16-18(10-15)27-11-21-16/h4-11H,1-3H2,(H,23,24) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
PDB
UniChem
Similars
| PDB
Article
PubMed
| n/a | n/a | n/a | n/a | 4.11E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of recombinant GST-tagged PPARgamma (unknown origin) expressed in Escherichia coli assessed as N-terminal biotin-labeled PNRC1 (302 t... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50244350
(CHEMBL4091374)Show SMILES OC(=O)CCCc1cc2cc(Cl)ccc2n1S(=O)(=O)c1ccc2ncsc2c1 Show InChI InChI=1S/C19H15ClN2O4S2/c20-13-4-7-17-12(8-13)9-14(2-1-3-19(23)24)22(17)28(25,26)15-5-6-16-18(10-15)27-11-21-16/h4-11H,1-3H2,(H,23,24) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
PDB
UniChem
Similars
| PDB
Article
PubMed
| n/a | n/a | n/a | n/a | 3.27E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of recombinant GST-tagged PPARgamma (unknown origin) expressed in Escherichia coli assessed as N-terminal biotin-labeled RIP140 (922 ... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50244345
(CHEMBL4098415)Show SMILES OC(=O)CCCc1cc2cc(ccc2n1S(=O)(=O)c1ccc(OC(F)(F)F)cc1)C(F)(F)F Show InChI InChI=1S/C20H15F6NO5S/c21-19(22,23)13-4-9-17-12(10-13)11-14(2-1-3-18(28)29)27(17)33(30,31)16-7-5-15(6-8-16)32-20(24,25)26/h4-11H,1-3H2,(H,28,29) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.96E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARalpha LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50244429
(CHEMBL4060007)Show SMILES COc1ccc(cc1)S(=O)(=O)n1c(CCCC(O)=O)cc2cc(ccc12)C(F)(F)F Show InChI InChI=1S/C20H18F3NO5S/c1-29-16-6-8-17(9-7-16)30(27,28)24-15(3-2-4-19(25)26)12-13-11-14(20(21,22)23)5-10-18(13)24/h5-12H,2-4H2,1H3,(H,25,26) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.26E+3 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARdelta LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50244432
(CHEMBL4103575)Show SMILES CC(C)(CCc1cc2cc(Cl)ccc2n1S(=O)(=O)c1ccccc1)C(O)=O Show InChI InChI=1S/C20H20ClNO4S/c1-20(2,19(23)24)11-10-16-13-14-12-15(21)8-9-18(14)22(16)27(25,26)17-6-4-3-5-7-17/h3-9,12-13H,10-11H2,1-2H3,(H,23,24) | 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 | 910 | n/a | n/a | n/a | n/a |
Inventiva
Curated by ChEMBL
| Assay Description
Transactivation of human GAL4-fused PPARgamma LBD expressed in African green monkey COS7 cells co-expressing 5Gal4 pGL3 TK Luc after overnight incuba... |
J Med Chem 61: 2246-2265 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01285
BindingDB Entry DOI: 10.7270/Q2MS3W58 |
More data for this
Ligand-Target Pair | |
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