BindingDB logo
myBDB logout
Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 496.5
BDBM50214892

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 3 hits in this display   
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))
BDBM50214892
PNG
(2-(3-((benzo[d]oxazol-2-yl(3-(2,4-difluorophenoxy)...)
Show SMILES CCC(Oc1cccc(CN(CCCOc2ccc(F)cc2F)c2nc3ccccc3o2)c1)C(O)=O |w:2.1|
Show InChI InChI=1S/C27H26F2N2O5/c1-2-23(26(32)33)35-20-8-5-7-18(15-20)17-31(27-30-22-9-3-4-10-25(22)36-27)13-6-14-34-24-12-11-19(28)16-21(24)29/h3-5,7-12,15-16,23H,2,6,13-14,17H2,1H3,(H,32,33)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

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



Kowa Co.

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant PPARalpha by GAL4 transactivation assay


Bioorg Med Chem Lett 17: 4689-93 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.066
BindingDB Entry DOI: 10.7270/Q2J67GM5
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50214892
PNG
(2-(3-((benzo[d]oxazol-2-yl(3-(2,4-difluorophenoxy)...)
Show SMILES CCC(Oc1cccc(CN(CCCOc2ccc(F)cc2F)c2nc3ccccc3o2)c1)C(O)=O |w:2.1|
Show InChI InChI=1S/C27H26F2N2O5/c1-2-23(26(32)33)35-20-8-5-7-18(15-20)17-31(27-30-22-9-3-4-10-25(22)36-27)13-6-14-34-24-12-11-19(28)16-21(24)29/h3-5,7-12,15-16,23H,2,6,13-14,17H2,1H3,(H,32,33)
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/an/an/an/a 2.10E+3n/an/an/an/a



Kowa Co.

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant PPARgamma by GAL4 transactivation assay


Bioorg Med Chem Lett 17: 4689-93 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.066
BindingDB Entry DOI: 10.7270/Q2J67GM5
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50214892
PNG
(2-(3-((benzo[d]oxazol-2-yl(3-(2,4-difluorophenoxy)...)
Show SMILES CCC(Oc1cccc(CN(CCCOc2ccc(F)cc2F)c2nc3ccccc3o2)c1)C(O)=O |w:2.1|
Show InChI InChI=1S/C27H26F2N2O5/c1-2-23(26(32)33)35-20-8-5-7-18(15-20)17-31(27-30-22-9-3-4-10-25(22)36-27)13-6-14-34-24-12-11-19(28)16-21(24)29/h3-5,7-12,15-16,23H,2,6,13-14,17H2,1H3,(H,32,33)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 6.50E+3n/an/an/an/a



Kowa Co.

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant PPARdelta by GAL4 transactivation assay


Bioorg Med Chem Lett 17: 4689-93 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.066
BindingDB Entry DOI: 10.7270/Q2J67GM5
More data for this
Ligand-Target Pair