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SMILES: Cc1oc(nc1CCOc1ccc(Cc2nn(nc2CC(O)=O)-c2ccccc2)cc1)-c1ccccc1

InChI Key: InChIKey=SEODTXMDIACADJ-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 = 50248463   
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))
BDBM50248463
PNG
(2-(5-(4-(2-(5-methyl-2-phenyloxazol-4-yl)ethoxy)be...)
Show SMILES Cc1oc(nc1CCOc1ccc(Cc2nn(nc2CC(O)=O)-c2ccccc2)cc1)-c1ccccc1
Show InChI InChI=1S/C29H26N4O4/c1-20-25(30-29(37-20)22-8-4-2-5-9-22)16-17-36-24-14-12-21(13-15-24)18-26-27(19-28(34)35)32-33(31-26)23-10-6-3-7-11-23/h2-15H,16-19H2,1H3,(H,34,35)
PDB

UniProtKB/SwissProt

antibodypedia
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CHEMBL
PC cid
PC sid
UniChem

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Similars

Article
PubMed
n/an/a 54n/an/an/an/an/an/a



Bristol-Myers Squibb Research and Development

Curated by ChEMBL


Assay Description
Binding affinity to PPARalpha (unknown origin) by fluorescence polarization assay


Bioorg Med Chem Lett 19: 1451-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.01.030
BindingDB Entry DOI: 10.7270/Q2MC8ZW8
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50248463
PNG
(2-(5-(4-(2-(5-methyl-2-phenyloxazol-4-yl)ethoxy)be...)
Show SMILES Cc1oc(nc1CCOc1ccc(Cc2nn(nc2CC(O)=O)-c2ccccc2)cc1)-c1ccccc1
Show InChI InChI=1S/C29H26N4O4/c1-20-25(30-29(37-20)22-8-4-2-5-9-22)16-17-36-24-14-12-21(13-15-24)18-26-27(19-28(34)35)32-33(31-26)23-10-6-3-7-11-23/h2-15H,16-19H2,1H3,(H,34,35)
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/an/an/an/a 13n/an/an/an/a



Bristol-Myers Squibb Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma ligand binding domain expressed in HEK293 cells by Gal4 transactivation assay


Bioorg Med Chem Lett 19: 1451-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.01.030
BindingDB Entry DOI: 10.7270/Q2MC8ZW8
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50248463
PNG
(2-(5-(4-(2-(5-methyl-2-phenyloxazol-4-yl)ethoxy)be...)
Show SMILES Cc1oc(nc1CCOc1ccc(Cc2nn(nc2CC(O)=O)-c2ccccc2)cc1)-c1ccccc1
Show InChI InChI=1S/C29H26N4O4/c1-20-25(30-29(37-20)22-8-4-2-5-9-22)16-17-36-24-14-12-21(13-15-24)18-26-27(19-28(34)35)32-33(31-26)23-10-6-3-7-11-23/h2-15H,16-19H2,1H3,(H,34,35)
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/an/a 7n/an/an/an/an/an/a



Bristol-Myers Squibb Research and Development

Curated by ChEMBL


Assay Description
Binding affinity to PPARgamma (unknown origin) by fluorescence polarization assay


Bioorg Med Chem Lett 19: 1451-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.01.030
BindingDB Entry DOI: 10.7270/Q2MC8ZW8
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50248463
PNG
(2-(5-(4-(2-(5-methyl-2-phenyloxazol-4-yl)ethoxy)be...)
Show SMILES Cc1oc(nc1CCOc1ccc(Cc2nn(nc2CC(O)=O)-c2ccccc2)cc1)-c1ccccc1
Show InChI InChI=1S/C29H26N4O4/c1-20-25(30-29(37-20)22-8-4-2-5-9-22)16-17-36-24-14-12-21(13-15-24)18-26-27(19-28(34)35)32-33(31-26)23-10-6-3-7-11-23/h2-15H,16-19H2,1H3,(H,34,35)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

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



Bristol-Myers Squibb Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha ligand binding domain expressed in HEK293 cells by Gal4 transactivation assay


Bioorg Med Chem Lett 19: 1451-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.01.030
BindingDB Entry DOI: 10.7270/Q2MC8ZW8
More data for this
Ligand-Target Pair