BindingDB logo
myBDB logout

PubMed code 22503460

Compile data set for download or QSAR
Found 37 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50382055
PNG
(CHEMBL2024606)
Show SMILES CCCCCS(=O)(=O)NC(=O)\C=C\c1ccc(OCCOC)cc1Oc1ncc(cc1Cl)C(F)(F)F
Show InChI InChI=1S/C23H26ClF3N2O6S/c1-3-4-5-12-36(31,32)29-21(30)9-7-16-6-8-18(34-11-10-33-2)14-20(16)35-22-19(24)13-17(15-28-22)23(25,26)27/h6-9,13-15H,3-5,10-12H2,1-2H3,(H,29,30)/b9-7+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 330n/an/an/an/an/an/a



Takeda Pharmaceutical Company, Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]-AD-5061 from human GST-tagged PPARgamma


Bioorg Med Chem 20: 3332-58 (2012)


Article DOI: 10.1016/j.bmc.2012.03.036
BindingDB Entry DOI: 10.7270/Q2NK3G26
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50382088
PNG
(CHEMBL2024613)
Show SMILES CCCCCS(=O)(=O)[N-]C(=O)\C=C\c1ccc(OCCOC)cc1Oc1ccc(cn1)C(F)(F)F
Show InChI InChI=1S/C23H27F3N2O6S/c1-3-4-5-14-35(30,31)28-21(29)10-7-17-6-9-19(33-13-12-32-2)15-20(17)34-22-11-8-18(16-27-22)23(24,25)26/h6-11,15-16H,3-5,12-14H2,1-2H3,(H,28,29)/p-1/b10-7+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

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



Takeda Pharmaceutical Company, Ltd

Curated by ChEMBL


Assay Description
Transactivation of human PPARgamma1 expressed in CHO-K1 cells co-expressing RXRalpha and PPRE after 1 day by luciferase reporter gene assay


Bioorg Med Chem 20: 3332-58 (2012)


Article DOI: 10.1016/j.bmc.2012.03.036
BindingDB Entry DOI: 10.7270/Q2NK3G26
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50382075
PNG
(CHEMBL2024618)
Show SMILES CCCCCS(=O)(=O)NC(=O)\C=C\c1ccc(OC(C)C)cc1Oc1ncc(cc1Cl)C(F)(F)F
Show InChI InChI=1S/C23H26ClF3N2O5S/c1-4-5-6-11-35(31,32)29-21(30)10-8-16-7-9-18(33-15(2)3)13-20(16)34-22-19(24)12-17(14-28-22)23(25,26)27/h7-10,12-15H,4-6,11H2,1-3H3,(H,29,30)/b10-8+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/an/an/a 26n/an/an/an/a



Takeda Pharmaceutical Company, Ltd

Curated by ChEMBL


Assay Description
Transactivation of human PPARgamma1 expressed in CHO-K1 cells co-expressing RXRalpha and PPRE after 1 day by luciferase reporter gene assay


Bioorg Med Chem 20: 3332-58 (2012)


Article DOI: 10.1016/j.bmc.2012.03.036
BindingDB Entry DOI: 10.7270/Q2NK3G26
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50382067
PNG
(CHEMBL2021928)
Show SMILES CCCCCS(=O)(=O)NC(=O)C(\C)=C\c1ccc(OCCOC)cc1Oc1ncc(cc1Cl)C(F)(F)F
Show InChI InChI=1S/C24H28ClF3N2O6S/c1-4-5-6-11-37(32,33)30-22(31)16(2)12-17-7-8-19(35-10-9-34-3)14-21(17)36-23-20(25)13-18(15-29-23)24(26,27)28/h7-8,12-15H,4-6,9-11H2,1-3H3,(H,30,31)/b16-12+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/an/an/a 5.20n/an/an/an/a



Takeda Pharmaceutical Company, Ltd

Curated by ChEMBL


Assay Description
Transactivation of human PPARgamma1 expressed in CHO-K1 cells co-expressing RXRalpha and PPRE after 1 day by luciferase reporter gene assay


Bioorg Med Chem 20: 3332-58 (2012)


Article DOI: 10.1016/j.bmc.2012.03.036
BindingDB Entry DOI: 10.7270/Q2NK3G26
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50382068
PNG
(CHEMBL2024610)
Show SMILES CCCCCS(=O)(=O)NC(=O)C(Cc1ccc(OCCOC)cc1Oc1ncc(cc1Cl)C(F)(F)F)OC
Show InChI InChI=1S/C24H30ClF3N2O7S/c1-4-5-6-11-38(32,33)30-22(31)21(35-3)12-16-7-8-18(36-10-9-34-2)14-20(16)37-23-19(25)13-17(15-29-23)24(26,27)28/h7-8,13-15,21H,4-6,9-12H2,1-3H3,(H,30,31)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/an/an/a 6.70n/an/an/an/a



Takeda Pharmaceutical Company, Ltd

Curated by ChEMBL


Assay Description
Transactivation of human PPARgamma1 expressed in CHO-K1 cells co-expressing RXRalpha and PPRE after 1 day by luciferase reporter gene assay


Bioorg Med Chem 20: 3332-58 (2012)


Article DOI: 10.1016/j.bmc.2012.03.036
BindingDB Entry DOI: 10.7270/Q2NK3G26
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50382080
PNG
(CHEMBL2022128)
Show SMILES CCCCCS(=O)(=O)NC(=O)\C=C\c1ccc(OCCCS(C)(=O)=O)cc1Oc1ncc(cc1Cl)C(F)(F)F
Show InChI InChI=1S/C24H28ClF3N2O7S2/c1-3-4-5-13-39(34,35)30-22(31)10-8-17-7-9-19(36-11-6-12-38(2,32)33)15-21(17)37-23-20(25)14-18(16-29-23)24(26,27)28/h7-10,14-16H,3-6,11-13H2,1-2H3,(H,30,31)/b10-8+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/an/an/a 320n/an/an/an/a



Takeda Pharmaceutical Company, Ltd

Curated by ChEMBL


Assay Description
Transactivation of human PPARgamma1 expressed in CHO-K1 cells co-expressing RXRalpha and PPRE after 1 day by luciferase reporter gene assay


Bioorg Med Chem 20: 3332-58 (2012)


Article DOI: 10.1016/j.bmc.2012.03.036
BindingDB Entry DOI: 10.7270/Q2NK3G26
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50382056
PNG
(CHEMBL2022743)
Show SMILES CCCCCS(=O)(=O)NC(=O)CCc1ccccc1Oc1ncc(cc1Cl)C(F)(F)F
Show InChI InChI=1S/C20H22ClF3N2O4S/c1-2-3-6-11-31(28,29)26-18(27)10-9-14-7-4-5-8-17(14)30-19-16(21)12-15(13-25-19)20(22,23)24/h4-5,7-8,12-13H,2-3,6,9-11H2,1H3,(H,26,27)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

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



Takeda Pharmaceutical Company, Ltd

Curated by ChEMBL


Assay Description
Transactivation of human PPARgamma1 expressed in CHO-K1 cells co-expressing RXRalpha and PPRE after 1 day by luciferase reporter gene assay


Bioorg Med Chem 20: 3332-58 (2012)


Article DOI: 10.1016/j.bmc.2012.03.036
BindingDB Entry DOI: 10.7270/Q2NK3G26
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50382066
PNG
(CHEMBL2024609)
Show SMILES CCCCCS(=O)(=O)NC(=O)C1CC1c1ccc(OCCOC)cc1Oc1ncc(cc1Cl)C(F)(F)F
Show InChI InChI=1S/C24H28ClF3N2O6S/c1-3-4-5-10-37(32,33)30-22(31)19-13-18(19)17-7-6-16(35-9-8-34-2)12-21(17)36-23-20(25)11-15(14-29-23)24(26,27)28/h6-7,11-12,14,18-19H,3-5,8-10,13H2,1-2H3,(H,30,31)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/an/an/a 5.5n/an/an/an/a



Takeda Pharmaceutical Company, Ltd

Curated by ChEMBL


Assay Description
Transactivation of human PPARgamma1 expressed in CHO-K1 cells co-expressing RXRalpha and PPRE after 1 day by luciferase reporter gene assay


Bioorg Med Chem 20: 3332-58 (2012)


Article DOI: 10.1016/j.bmc.2012.03.036
BindingDB Entry DOI: 10.7270/Q2NK3G26
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50382073
PNG
(CHEMBL2024616)
Show SMILES CCCCCS(=O)(=O)NC(=O)\C=C\c1ccc(OCCOC)cc1Oc1ncc(N)cc1C
Show InChI InChI=1S/C23H31N3O6S/c1-4-5-6-13-33(28,29)26-22(27)10-8-18-7-9-20(31-12-11-30-3)15-21(18)32-23-17(2)14-19(24)16-25-23/h7-10,14-16H,4-6,11-13,24H2,1-3H3,(H,26,27)/b10-8+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

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



Takeda Pharmaceutical Company, Ltd

Curated by ChEMBL


Assay Description
Transactivation of human PPARgamma1 expressed in CHO-K1 cells co-expressing RXRalpha and PPRE after 1 day by luciferase reporter gene assay


Bioorg Med Chem 20: 3332-58 (2012)


Article DOI: 10.1016/j.bmc.2012.03.036
BindingDB Entry DOI: 10.7270/Q2NK3G26
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50382079
PNG
(CHEMBL2022127)
Show SMILES CCCCCS(=O)(=O)NC(=O)\C=C\c1ccc(OCCC(C)=O)cc1Oc1ncc(cc1Cl)C(F)(F)F
Show InChI InChI=1S/C24H26ClF3N2O6S/c1-3-4-5-12-37(33,34)30-22(32)9-7-17-6-8-19(35-11-10-16(2)31)14-21(17)36-23-20(25)13-18(15-29-23)24(26,27)28/h6-9,13-15H,3-5,10-12H2,1-2H3,(H,30,32)/b9-7+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/an/an/a 59n/an/an/an/a



Takeda Pharmaceutical Company, Ltd

Curated by ChEMBL


Assay Description
Transactivation of human PPARgamma1 expressed in CHO-K1 cells co-expressing RXRalpha and PPRE after 1 day by luciferase reporter gene assay


Bioorg Med Chem 20: 3332-58 (2012)


Article DOI: 10.1016/j.bmc.2012.03.036
BindingDB Entry DOI: 10.7270/Q2NK3G26
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50382085
PNG
(CHEMBL2022133)
Show SMILES CCCCNC(=O)OCCCc1ccc(OCCOC)cc1Oc1ncc(cc1Cl)C(F)(F)F
Show InChI InChI=1S/C23H28ClF3N2O5/c1-3-4-9-28-22(30)33-10-5-6-16-7-8-18(32-12-11-31-2)14-20(16)34-21-19(24)13-17(15-29-21)23(25,26)27/h7-8,13-15H,3-6,9-12H2,1-2H3,(H,28,30)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/an/an/a 48n/an/an/an/a



Takeda Pharmaceutical Company, Ltd

Curated by ChEMBL


Assay Description
Transactivation of human PPARgamma1 expressed in CHO-K1 cells co-expressing RXRalpha and PPRE after 1 day by luciferase reporter gene assay


Bioorg Med Chem 20: 3332-58 (2012)


Article DOI: 10.1016/j.bmc.2012.03.036
BindingDB Entry DOI: 10.7270/Q2NK3G26
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50382064
PNG
(CHEMBL2024607)
Show SMILES CCCCCS(=O)(=O)NC(=O)C(C)Cc1ccc(OCCOC)cc1Oc1ncc(cc1Cl)C(F)(F)F
Show InChI InChI=1S/C24H30ClF3N2O6S/c1-4-5-6-11-37(32,33)30-22(31)16(2)12-17-7-8-19(35-10-9-34-3)14-21(17)36-23-20(25)13-18(15-29-23)24(26,27)28/h7-8,13-16H,4-6,9-12H2,1-3H3,(H,30,31)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/an/an/a 2.30n/an/an/an/a



Takeda Pharmaceutical Company, Ltd

Curated by ChEMBL


Assay Description
Transactivation of human PPARgamma1 expressed in CHO-K1 cells co-expressing RXRalpha and PPRE after 1 day by luciferase reporter gene assay


Bioorg Med Chem 20: 3332-58 (2012)


Article DOI: 10.1016/j.bmc.2012.03.036
BindingDB Entry DOI: 10.7270/Q2NK3G26
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50382071
PNG
(CHEMBL2024614)
Show SMILES CCCCCS(=O)(=O)NC(=O)\C=C\c1ccc(OCCOC)cc1Oc1ncccc1Cl
Show InChI InChI=1S/C22H27ClN2O6S/c1-3-4-5-15-32(27,28)25-21(26)11-9-17-8-10-18(30-14-13-29-2)16-20(17)31-22-19(23)7-6-12-24-22/h6-12,16H,3-5,13-15H2,1-2H3,(H,25,26)/b11-9+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

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



Takeda Pharmaceutical Company, Ltd

Curated by ChEMBL


Assay Description
Transactivation of human PPARgamma1 expressed in CHO-K1 cells co-expressing RXRalpha and PPRE after 1 day by luciferase reporter gene assay


Bioorg Med Chem 20: 3332-58 (2012)


Article DOI: 10.1016/j.bmc.2012.03.036
BindingDB Entry DOI: 10.7270/Q2NK3G26
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50382078
PNG
(CHEMBL2022126)
Show SMILES CCCCCS(=O)(=O)NC(=O)\C=C\c1ccc(OCCO)cc1Oc1ncc(cc1Cl)C(F)(F)F
Show InChI InChI=1S/C22H24ClF3N2O6S/c1-2-3-4-11-35(31,32)28-20(30)8-6-15-5-7-17(33-10-9-29)13-19(15)34-21-18(23)12-16(14-27-21)22(24,25)26/h5-8,12-14,29H,2-4,9-11H2,1H3,(H,28,30)/b8-6+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/an/an/a 80n/an/an/an/a



Takeda Pharmaceutical Company, Ltd

Curated by ChEMBL


Assay Description
Transactivation of human PPARgamma1 expressed in CHO-K1 cells co-expressing RXRalpha and PPRE after 1 day by luciferase reporter gene assay


Bioorg Med Chem 20: 3332-58 (2012)


Article DOI: 10.1016/j.bmc.2012.03.036
BindingDB Entry DOI: 10.7270/Q2NK3G26
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50382059
PNG
(CHEMBL2022746)
Show SMILES CCCCCS(=O)(=O)NC(=O)CCc1ccc(OCC(=O)N(CC)CC)cc1Oc1ncc(cc1Cl)C(F)(F)F
Show InChI InChI=1S/C26H33ClF3N3O6S/c1-4-7-8-13-40(36,37)32-23(34)12-10-18-9-11-20(38-17-24(35)33(5-2)6-3)15-22(18)39-25-21(27)14-19(16-31-25)26(28,29)30/h9,11,14-16H,4-8,10,12-13,17H2,1-3H3,(H,32,34)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/an/an/a 6.90n/an/an/an/a



Takeda Pharmaceutical Company, Ltd

Curated by ChEMBL


Assay Description
Transactivation of human PPARgamma1 expressed in CHO-K1 cells co-expressing RXRalpha and PPRE after 1 day by luciferase reporter gene assay


Bioorg Med Chem 20: 3332-58 (2012)


Article DOI: 10.1016/j.bmc.2012.03.036
BindingDB Entry DOI: 10.7270/Q2NK3G26
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50382063
PNG
(CHEMBL2024605)
Show SMILES COCCOc1ccc(CCC(=O)NS(=O)(=O)c2ccc(Cl)cc2)c(Oc2ncc(cc2Cl)C(F)(F)F)c1
Show InChI InChI=1S/C24H21Cl2F3N2O6S/c1-35-10-11-36-18-6-2-15(3-9-22(32)31-38(33,34)19-7-4-17(25)5-8-19)21(13-18)37-23-20(26)12-16(14-30-23)24(27,28)29/h2,4-8,12-14H,3,9-11H2,1H3,(H,31,32)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/an/an/a 8.60n/an/an/an/a



Takeda Pharmaceutical Company, Ltd

Curated by ChEMBL


Assay Description
Transactivation of human PPARgamma1 expressed in CHO-K1 cells co-expressing RXRalpha and PPRE after 1 day by luciferase reporter gene assay


Bioorg Med Chem 20: 3332-58 (2012)


Article DOI: 10.1016/j.bmc.2012.03.036
BindingDB Entry DOI: 10.7270/Q2NK3G26
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50382070
PNG
(CHEMBL2024612)
Show SMILES CCCCCS(=O)(=O)NC(=O)\C=C\c1ccc(OCCOC)cc1Oc1ccc(cc1Cl)C(F)(F)F
Show InChI InChI=1S/C24H27ClF3NO6S/c1-3-4-5-14-36(31,32)29-23(30)11-7-17-6-9-19(34-13-12-33-2)16-22(17)35-21-10-8-18(15-20(21)25)24(26,27)28/h6-11,15-16H,3-5,12-14H2,1-2H3,(H,29,30)/b11-7+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 94n/an/an/an/a



Takeda Pharmaceutical Company, Ltd

Curated by ChEMBL


Assay Description
Transactivation of human PPARgamma1 expressed in CHO-K1 cells co-expressing RXRalpha and PPRE after 1 day by luciferase reporter gene assay


Bioorg Med Chem 20: 3332-58 (2012)


Article DOI: 10.1016/j.bmc.2012.03.036
BindingDB Entry DOI: 10.7270/Q2NK3G26
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50382082
PNG
(CHEMBL2022130)
Show SMILES CCCCCNC(=O)CCc1ccc(OC(C)C)cc1Oc1ncc(cc1Cl)C(F)(F)F
Show InChI InChI=1S/C23H28ClF3N2O3/c1-4-5-6-11-28-21(30)10-8-16-7-9-18(31-15(2)3)13-20(16)32-22-19(24)12-17(14-29-22)23(25,26)27/h7,9,12-15H,4-6,8,10-11H2,1-3H3,(H,28,30)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 290n/an/an/an/a



Takeda Pharmaceutical Company, Ltd

Curated by ChEMBL


Assay Description
Transactivation of human PPARgamma1 expressed in CHO-K1 cells co-expressing RXRalpha and PPRE after 1 day by luciferase reporter gene assay


Bioorg Med Chem 20: 3332-58 (2012)


Article DOI: 10.1016/j.bmc.2012.03.036
BindingDB Entry DOI: 10.7270/Q2NK3G26
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50382084
PNG
(CHEMBL2022132)
Show SMILES CCCCOC(=O)NCCCc1ccc(OCCOC)cc1Oc1ncc(cc1Cl)C(F)(F)F
Show InChI InChI=1S/C23H28ClF3N2O5/c1-3-4-10-33-22(30)28-9-5-6-16-7-8-18(32-12-11-31-2)14-20(16)34-21-19(24)13-17(15-29-21)23(25,26)27/h7-8,13-15H,3-6,9-12H2,1-2H3,(H,28,30)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/an/an/a 38n/an/an/an/a



Takeda Pharmaceutical Company, Ltd

Curated by ChEMBL


Assay Description
Transactivation of human PPARgamma1 expressed in CHO-K1 cells co-expressing RXRalpha and PPRE after 1 day by luciferase reporter gene assay


Bioorg Med Chem 20: 3332-58 (2012)


Article DOI: 10.1016/j.bmc.2012.03.036
BindingDB Entry DOI: 10.7270/Q2NK3G26
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50382058
PNG
(CHEMBL2022745)
Show SMILES CCCCCS(=O)(=O)NC(=O)CCc1ccc(OCCOC)cc1Oc1ncc(cc1Cl)C(F)(F)F
Show InChI InChI=1S/C23H28ClF3N2O6S/c1-3-4-5-12-36(31,32)29-21(30)9-7-16-6-8-18(34-11-10-33-2)14-20(16)35-22-19(24)13-17(15-28-22)23(25,26)27/h6,8,13-15H,3-5,7,9-12H2,1-2H3,(H,29,30)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/an/an/a 1.5n/an/an/an/a



Takeda Pharmaceutical Company, Ltd

Curated by ChEMBL


Assay Description
Transactivation of human PPARgamma1 expressed in CHO-K1 cells co-expressing RXRalpha and PPRE after 1 day by luciferase reporter gene assay


Bioorg Med Chem 20: 3332-58 (2012)


Article DOI: 10.1016/j.bmc.2012.03.036
BindingDB Entry DOI: 10.7270/Q2NK3G26
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50382077
PNG
(CHEMBL2022125)
Show SMILES CCCCCS(=O)(=O)NC(=O)\C=C\c1ccc(OCCCOC)cc1Oc1ncc(cc1Cl)C(F)(F)F
Show InChI InChI=1S/C24H28ClF3N2O6S/c1-3-4-5-13-37(32,33)30-22(31)10-8-17-7-9-19(35-12-6-11-34-2)15-21(17)36-23-20(25)14-18(16-29-23)24(26,27)28/h7-10,14-16H,3-6,11-13H2,1-2H3,(H,30,31)/b10-8+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/an/an/a 7.40n/an/an/an/a



Takeda Pharmaceutical Company, Ltd

Curated by ChEMBL


Assay Description
Transactivation of human PPARgamma1 expressed in CHO-K1 cells co-expressing RXRalpha and PPRE after 1 day by luciferase reporter gene assay


Bioorg Med Chem 20: 3332-58 (2012)


Article DOI: 10.1016/j.bmc.2012.03.036
BindingDB Entry DOI: 10.7270/Q2NK3G26
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50382081
PNG
(CHEMBL2022129)
Show SMILES CCCCCS(=O)(=O)NC(=O)\C=C\c1ccc(OCCCC#N)cc1Oc1ncc(cc1Cl)C(F)(F)F
Show InChI InChI=1S/C24H25ClF3N3O5S/c1-2-3-6-13-37(33,34)31-22(32)10-8-17-7-9-19(35-12-5-4-11-29)15-21(17)36-23-20(25)14-18(16-30-23)24(26,27)28/h7-10,14-16H,2-6,12-13H2,1H3,(H,31,32)/b10-8+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/an/an/a 15n/an/an/an/a



Takeda Pharmaceutical Company, Ltd

Curated by ChEMBL


Assay Description
Transactivation of human PPARgamma1 expressed in CHO-K1 cells co-expressing RXRalpha and PPRE after 1 day by luciferase reporter gene assay


Bioorg Med Chem 20: 3332-58 (2012)


Article DOI: 10.1016/j.bmc.2012.03.036
BindingDB Entry DOI: 10.7270/Q2NK3G26
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50382083
PNG
(CHEMBL2022131)
Show SMILES CCCCCS(=O)(=O)NCCCc1ccc(OCCOC)cc1Oc1ncc(cc1Cl)C(F)(F)F
Show InChI InChI=1S/C23H30ClF3N2O5S/c1-3-4-5-13-35(30,31)29-10-6-7-17-8-9-19(33-12-11-32-2)15-21(17)34-22-20(24)14-18(16-28-22)23(25,26)27/h8-9,14-16,29H,3-7,10-13H2,1-2H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/an/an/a 32n/an/an/an/a



Takeda Pharmaceutical Company, Ltd

Curated by ChEMBL


Assay Description
Transactivation of human PPARgamma1 expressed in CHO-K1 cells co-expressing RXRalpha and PPRE after 1 day by luciferase reporter gene assay


Bioorg Med Chem 20: 3332-58 (2012)


Article DOI: 10.1016/j.bmc.2012.03.036
BindingDB Entry DOI: 10.7270/Q2NK3G26
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50382086
PNG
(CHEMBL2022134)
Show SMILES CCCCCS(=O)(=O)NC(=O)OCCCc1ccc(OCCOC)cc1Oc1ncc(cc1Cl)C(F)(F)F
Show InChI InChI=1S/C24H30ClF3N2O7S/c1-3-4-5-13-38(32,33)30-23(31)36-10-6-7-17-8-9-19(35-12-11-34-2)15-21(17)37-22-20(25)14-18(16-29-22)24(26,27)28/h8-9,14-16H,3-7,10-13H2,1-2H3,(H,30,31)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/an/an/a 4.5n/an/an/an/a



Takeda Pharmaceutical Company, Ltd

Curated by ChEMBL


Assay Description
Transactivation of human PPARgamma1 expressed in CHO-K1 cells co-expressing RXRalpha and PPRE after 1 day by luciferase reporter gene assay


Bioorg Med Chem 20: 3332-58 (2012)


Article DOI: 10.1016/j.bmc.2012.03.036
BindingDB Entry DOI: 10.7270/Q2NK3G26
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50382074
PNG
(CHEMBL2024617)
Show SMILES CCCCCS(=O)(=O)NC(=O)\C=C\c1ccc(OCCOC)cc1Oc1ncc(NC(C)=O)cc1C
Show InChI InChI=1S/C25H33N3O7S/c1-5-6-7-14-36(31,32)28-24(30)11-9-20-8-10-22(34-13-12-33-4)16-23(20)35-25-18(2)15-21(17-26-25)27-19(3)29/h8-11,15-17H,5-7,12-14H2,1-4H3,(H,27,29)(H,28,30)/b11-9+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

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



Takeda Pharmaceutical Company, Ltd

Curated by ChEMBL


Assay Description
Transactivation of human PPARgamma1 expressed in CHO-K1 cells co-expressing RXRalpha and PPRE after 1 day by luciferase reporter gene assay


Bioorg Med Chem 20: 3332-58 (2012)


Article DOI: 10.1016/j.bmc.2012.03.036
BindingDB Entry DOI: 10.7270/Q2NK3G26
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (PPAR delta)


(Homo sapiens (Human))
BDBM50382055
PNG
(CHEMBL2024606)
Show SMILES CCCCCS(=O)(=O)NC(=O)\C=C\c1ccc(OCCOC)cc1Oc1ncc(cc1Cl)C(F)(F)F
Show InChI InChI=1S/C23H26ClF3N2O6S/c1-3-4-5-12-36(31,32)29-21(30)9-7-16-6-8-18(34-11-10-33-2)14-20(16)35-22-19(24)13-17(15-28-22)23(25,26)27/h6-9,13-15H,3-5,10-12H2,1-2H3,(H,29,30)/b9-7+
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

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



Takeda Pharmaceutical Company, Ltd

Curated by ChEMBL


Assay Description
Transactivation of human PPARdelta expressed in african green monkey COS1 cells after 1 day by luciferase reporter gene assay


Bioorg Med Chem 20: 3332-58 (2012)


Article DOI: 10.1016/j.bmc.2012.03.036
BindingDB Entry DOI: 10.7270/Q2NK3G26
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50382057
PNG
(CHEMBL2022744)
Show SMILES CCCCCS(=O)(=O)NC(=O)CCc1ccc(OC(C)C)cc1Oc1ncc(cc1Cl)C(F)(F)F
Show InChI InChI=1S/C23H28ClF3N2O5S/c1-4-5-6-11-35(31,32)29-21(30)10-8-16-7-9-18(33-15(2)3)13-20(16)34-22-19(24)12-17(14-28-22)23(25,26)27/h7,9,12-15H,4-6,8,10-11H2,1-3H3,(H,29,30)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/an/an/a 2.60n/an/an/an/a



Takeda Pharmaceutical Company, Ltd

Curated by ChEMBL


Assay Description
Transactivation of human PPARgamma1 expressed in CHO-K1 cells co-expressing RXRalpha and PPRE after 1 day by luciferase reporter gene assay


Bioorg Med Chem 20: 3332-58 (2012)


Article DOI: 10.1016/j.bmc.2012.03.036
BindingDB Entry DOI: 10.7270/Q2NK3G26
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50382060
PNG
(CHEMBL2022747)
Show SMILES CCCCCS(=O)(=O)NC(=O)CCc1ccc(OCCN2CCCC2=O)cc1Oc1ncc(cc1Cl)C(F)(F)F
Show InChI InChI=1S/C26H31ClF3N3O6S/c1-2-3-4-14-40(36,37)32-23(34)10-8-18-7-9-20(38-13-12-33-11-5-6-24(33)35)16-22(18)39-25-21(27)15-19(17-31-25)26(28,29)30/h7,9,15-17H,2-6,8,10-14H2,1H3,(H,32,34)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/an/an/a 3.40n/an/an/an/a



Takeda Pharmaceutical Company, Ltd

Curated by ChEMBL


Assay Description
Transactivation of human PPARgamma1 expressed in CHO-K1 cells co-expressing RXRalpha and PPRE after 1 day by luciferase reporter gene assay


Bioorg Med Chem 20: 3332-58 (2012)


Article DOI: 10.1016/j.bmc.2012.03.036
BindingDB Entry DOI: 10.7270/Q2NK3G26
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50382055
PNG
(CHEMBL2024606)
Show SMILES CCCCCS(=O)(=O)NC(=O)\C=C\c1ccc(OCCOC)cc1Oc1ncc(cc1Cl)C(F)(F)F
Show InChI InChI=1S/C23H26ClF3N2O6S/c1-3-4-5-12-36(31,32)29-21(30)9-7-16-6-8-18(34-11-10-33-2)14-20(16)35-22-19(24)13-17(15-28-22)23(25,26)27/h6-9,13-15H,3-5,10-12H2,1-2H3,(H,29,30)/b9-7+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/an/an/a 15n/an/an/an/a



Takeda Pharmaceutical Company, Ltd

Curated by ChEMBL


Assay Description
Transactivation of human PPARgamma1 expressed in CHO-K1 cells co-expressing RXRalpha and PPRE after 1 day by luciferase reporter gene assay


Bioorg Med Chem 20: 3332-58 (2012)


Article DOI: 10.1016/j.bmc.2012.03.036
BindingDB Entry DOI: 10.7270/Q2NK3G26
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50382065
PNG
(CHEMBL2024608)
Show SMILES CCCCCS(=O)(=O)[N-]C(=O)C(C)(C)Cc1ccc(OCCOC)cc1Oc1ncc(cc1Cl)C(F)(F)F
Show InChI InChI=1S/C25H32ClF3N2O6S/c1-5-6-7-12-38(33,34)31-23(32)24(2,3)15-17-8-9-19(36-11-10-35-4)14-21(17)37-22-20(26)13-18(16-30-22)25(27,28)29/h8-9,13-14,16H,5-7,10-12,15H2,1-4H3,(H,31,32)/p-1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/an/an/a 3.10n/an/an/an/a



Takeda Pharmaceutical Company, Ltd

Curated by ChEMBL


Assay Description
Transactivation of human PPARgamma1 expressed in CHO-K1 cells co-expressing RXRalpha and PPRE after 1 day by luciferase reporter gene assay


Bioorg Med Chem 20: 3332-58 (2012)


Article DOI: 10.1016/j.bmc.2012.03.036
BindingDB Entry DOI: 10.7270/Q2NK3G26
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50382069
PNG
(CHEMBL2024611)
Show SMILES CCCCCS(=O)(=O)NC(=O)OCc1ccc(OCCOC)cc1Oc1ncc(cc1Cl)C(F)(F)F
Show InChI InChI=1S/C22H26ClF3N2O7S/c1-3-4-5-10-36(30,31)28-21(29)34-14-15-6-7-17(33-9-8-32-2)12-19(15)35-20-18(23)11-16(13-27-20)22(24,25)26/h6-7,11-13H,3-5,8-10,14H2,1-2H3,(H,28,29)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

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



Takeda Pharmaceutical Company, Ltd

Curated by ChEMBL


Assay Description
Transactivation of human PPARgamma1 expressed in CHO-K1 cells co-expressing RXRalpha and PPRE after 1 day by luciferase reporter gene assay


Bioorg Med Chem 20: 3332-58 (2012)


Article DOI: 10.1016/j.bmc.2012.03.036
BindingDB Entry DOI: 10.7270/Q2NK3G26
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50382072
PNG
(CHEMBL2024615)
Show SMILES CCCCCS(=O)(=O)NC(=O)\C=C\c1ccc(OCCOC)cc1Oc1ncc(Cl)cc1Cl
Show InChI InChI=1S/C22H26Cl2N2O6S/c1-3-4-5-12-33(28,29)26-21(27)9-7-16-6-8-18(31-11-10-30-2)14-20(16)32-22-19(24)13-17(23)15-25-22/h6-9,13-15H,3-5,10-12H2,1-2H3,(H,26,27)/b9-7+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

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



Takeda Pharmaceutical Company, Ltd

Curated by ChEMBL


Assay Description
Transactivation of human PPARgamma1 expressed in CHO-K1 cells co-expressing RXRalpha and PPRE after 1 day by luciferase reporter gene assay


Bioorg Med Chem 20: 3332-58 (2012)


Article DOI: 10.1016/j.bmc.2012.03.036
BindingDB Entry DOI: 10.7270/Q2NK3G26
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50382076
PNG
(CHEMBL2024619)
Show SMILES CCCCCS(=O)(=O)NC(=O)\C=C\c1ccc(OCCOC2CC2)cc1Oc1ncc(cc1Cl)C(F)(F)F
Show InChI InChI=1S/C25H28ClF3N2O6S/c1-2-3-4-13-38(33,34)31-23(32)10-6-17-5-7-20(36-12-11-35-19-8-9-19)15-22(17)37-24-21(26)14-18(16-30-24)25(27,28)29/h5-7,10,14-16,19H,2-4,8-9,11-13H2,1H3,(H,31,32)/b10-6+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/an/an/a 6.20n/an/an/an/a



Takeda Pharmaceutical Company, Ltd

Curated by ChEMBL


Assay Description
Transactivation of human PPARgamma1 expressed in CHO-K1 cells co-expressing RXRalpha and PPRE after 1 day by luciferase reporter gene assay


Bioorg Med Chem 20: 3332-58 (2012)


Article DOI: 10.1016/j.bmc.2012.03.036
BindingDB Entry DOI: 10.7270/Q2NK3G26
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50382087
PNG
(CHEMBL2021930)
Show SMILES CCCCCNS(=O)(=O)NC(=O)CCc1ccc(OCCOC)cc1Oc1ncc(cc1Cl)C(F)(F)F
Show InChI InChI=1S/C23H29ClF3N3O6S/c1-3-4-5-10-29-37(32,33)30-21(31)9-7-16-6-8-18(35-12-11-34-2)14-20(16)36-22-19(24)13-17(15-28-22)23(25,26)27/h6,8,13-15,29H,3-5,7,9-12H2,1-2H3,(H,30,31)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/an/an/a 1.10n/an/an/an/a



Takeda Pharmaceutical Company, Ltd

Curated by ChEMBL


Assay Description
Transactivation of human PPARgamma1 expressed in CHO-K1 cells co-expressing RXRalpha and PPRE after 1 day by luciferase reporter gene assay


Bioorg Med Chem 20: 3332-58 (2012)


Article DOI: 10.1016/j.bmc.2012.03.036
BindingDB Entry DOI: 10.7270/Q2NK3G26
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50382055
PNG
(CHEMBL2024606)
Show SMILES CCCCCS(=O)(=O)NC(=O)\C=C\c1ccc(OCCOC)cc1Oc1ncc(cc1Cl)C(F)(F)F
Show InChI InChI=1S/C23H26ClF3N2O6S/c1-3-4-5-12-36(31,32)29-21(30)9-7-16-6-8-18(34-11-10-33-2)14-20(16)35-22-19(24)13-17(15-28-22)23(25,26)27/h6-9,13-15H,3-5,10-12H2,1-2H3,(H,29,30)/b9-7+
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

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



Takeda Pharmaceutical Company, Ltd

Curated by ChEMBL


Assay Description
Transactivation of human PPARalpha expressed in african green monkey COS1 cells after 1 day by luciferase reporter gene assay


Bioorg Med Chem 20: 3332-58 (2012)


Article DOI: 10.1016/j.bmc.2012.03.036
BindingDB Entry DOI: 10.7270/Q2NK3G26
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50382061
PNG
(CHEMBL2022748)
Show SMILES COCCCS(=O)(=O)NC(=O)CCc1ccc(OCCOC)cc1Oc1ncc(cc1Cl)C(F)(F)F
Show InChI InChI=1S/C22H26ClF3N2O7S/c1-32-8-3-11-36(30,31)28-20(29)7-5-15-4-6-17(34-10-9-33-2)13-19(15)35-21-18(23)12-16(14-27-21)22(24,25)26/h4,6,12-14H,3,5,7-11H2,1-2H3,(H,28,29)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/an/an/a 11n/an/an/an/a



Takeda Pharmaceutical Company, Ltd

Curated by ChEMBL


Assay Description
Transactivation of human PPARgamma1 expressed in CHO-K1 cells co-expressing RXRalpha and PPRE after 1 day by luciferase reporter gene assay


Bioorg Med Chem 20: 3332-58 (2012)


Article DOI: 10.1016/j.bmc.2012.03.036
BindingDB Entry DOI: 10.7270/Q2NK3G26
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50382062
PNG
(CHEMBL2024604)
Show SMILES COCCOc1ccc(CCC(=O)NS(=O)(=O)c2ccccc2)c(Oc2ncc(cc2Cl)C(F)(F)F)c1
Show InChI InChI=1S/C24H22ClF3N2O6S/c1-34-11-12-35-18-9-7-16(8-10-22(31)30-37(32,33)19-5-3-2-4-6-19)21(14-18)36-23-20(25)13-17(15-29-23)24(26,27)28/h2-7,9,13-15H,8,10-12H2,1H3,(H,30,31)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/an/an/a 32n/an/an/an/a



Takeda Pharmaceutical Company, Ltd

Curated by ChEMBL


Assay Description
Transactivation of human PPARgamma1 expressed in CHO-K1 cells co-expressing RXRalpha and PPRE after 1 day by luciferase reporter gene assay


Bioorg Med Chem 20: 3332-58 (2012)


Article DOI: 10.1016/j.bmc.2012.03.036
BindingDB Entry DOI: 10.7270/Q2NK3G26
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%