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SMILES: COc1ccc(OC(=O)N(CC(O)=O)Cc2ccc(O)cc2)cc1

InChI Key: InChIKey=GQHGGKPOZFTGOJ-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50376413   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50376413
PNG
(CHEMBL444373)
Show SMILES COc1ccc(OC(=O)N(CC(O)=O)Cc2ccc(O)cc2)cc1
Show InChI InChI=1S/C17H17NO6/c1-23-14-6-8-15(9-7-14)24-17(22)18(11-16(20)21)10-12-2-4-13(19)5-3-12/h2-9,19H,10-11H2,1H3,(H,20,21)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>1.50E+4n/an/an/an/an/an/a



Bristol-Myers Squibb

Curated by ChEMBL


Assay Description
Binding affinity at PPAR alpha receptor


Drug Metab Dispos 35: 150-67 (2006)


Article DOI: 10.1124/dmd.106.012450
BindingDB Entry DOI: 10.7270/Q2JS9R92
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50376413
PNG
(CHEMBL444373)
Show SMILES COc1ccc(OC(=O)N(CC(O)=O)Cc2ccc(O)cc2)cc1
Show InChI InChI=1S/C17H17NO6/c1-23-14-6-8-15(9-7-14)24-17(22)18(11-16(20)21)10-12-2-4-13(19)5-3-12/h2-9,19H,10-11H2,1H3,(H,20,21)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>1.50E+4n/an/an/an/an/an/a



Bristol-Myers Squibb

Curated by ChEMBL


Assay Description
Binding affinity at PPAR gamma receptor


Drug Metab Dispos 35: 150-67 (2006)


Article DOI: 10.1124/dmd.106.012450
BindingDB Entry DOI: 10.7270/Q2JS9R92
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50376413
PNG
(CHEMBL444373)
Show SMILES COc1ccc(OC(=O)N(CC(O)=O)Cc2ccc(O)cc2)cc1
Show InChI InChI=1S/C17H17NO6/c1-23-14-6-8-15(9-7-14)24-17(22)18(11-16(20)21)10-12-2-4-13(19)5-3-12/h2-9,19H,10-11H2,1H3,(H,20,21)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>2.00E+4n/an/an/an/an/an/a



Bristol-Myers Squibb

Curated by ChEMBL


Assay Description
Agonist activity at PPAR gamma in human HEK cells by transactivation assay


Drug Metab Dispos 35: 150-67 (2006)


Article DOI: 10.1124/dmd.106.012450
BindingDB Entry DOI: 10.7270/Q2JS9R92
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50376413
PNG
(CHEMBL444373)
Show SMILES COc1ccc(OC(=O)N(CC(O)=O)Cc2ccc(O)cc2)cc1
Show InChI InChI=1S/C17H17NO6/c1-23-14-6-8-15(9-7-14)24-17(22)18(11-16(20)21)10-12-2-4-13(19)5-3-12/h2-9,19H,10-11H2,1H3,(H,20,21)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a>2.50E+4n/an/an/an/a



Bristol-Myers Squibb

Curated by ChEMBL


Assay Description
Agonist activity at PPAR alpha in human HEK cells by transactivation assay


Drug Metab Dispos 35: 150-67 (2006)


Article DOI: 10.1124/dmd.106.012450
BindingDB Entry DOI: 10.7270/Q2JS9R92
More data for this
Ligand-Target Pair