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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Peroxisome proliferator-activated receptor alpha' and Ligand = 'BDBM50205077'   
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 alpha


(Homo sapiens (Human))
BDBM50205077
PNG
(2-((4-(2-(5-methyl-2-phenyloxazol-4-yl)ethoxy)benz...)
Show SMILES CCCCCCCN(CC(O)=O)Cc1ccc(OCCc2nc(oc2C)-c2ccccc2)cc1
Show InChI InChI=1S/C28H36N2O4/c1-3-4-5-6-10-18-30(21-27(31)32)20-23-13-15-25(16-14-23)33-19-17-26-22(2)34-28(29-26)24-11-8-7-9-12-24/h7-9,11-16H,3-6,10,17-21H2,1-2H3,(H,31,32)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.05E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of fluorescein labeled ligand from PPARalpha receptor by fluorescence polarization assay


Bioorg Med Chem Lett 17: 2312-6 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.060
BindingDB Entry DOI: 10.7270/Q21N80ST
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50205077
PNG
(2-((4-(2-(5-methyl-2-phenyloxazol-4-yl)ethoxy)benz...)
Show SMILES CCCCCCCN(CC(O)=O)Cc1ccc(OCCc2nc(oc2C)-c2ccccc2)cc1
Show InChI InChI=1S/C28H36N2O4/c1-3-4-5-6-10-18-30(21-27(31)32)20-23-13-15-25(16-14-23)33-19-17-26-22(2)34-28(29-26)24-11-8-7-9-12-24/h7-9,11-16H,3-6,10,17-21H2,1-2H3,(H,31,32)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 180n/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at PPARalpha receptor expressed in HEK293 cells by GAL4 transactivation assay


Bioorg Med Chem Lett 17: 2312-6 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.060
BindingDB Entry DOI: 10.7270/Q21N80ST
More data for this
Ligand-Target Pair