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BDBM50317115 2-((3-((2-(2,4-difluorophenyl)oxazol-4-yl)methoxy)benzyl)(methoxycarbonyl)amino)acetic acid::CHEMBL1087336

SMILES: COC(=O)N(CC(O)=O)Cc1cccc(OCc2coc(n2)-c2ccc(F)cc2F)c1

InChI Key: InChIKey=ZYLUUHBSGBPDTC-UHFFFAOYSA-N

Data: 2 EC50

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 2 hits for monomerid = 50317115   
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))
BDBM50317115
PNG
(2-((3-((2-(2,4-difluorophenyl)oxazol-4-yl)methoxy)...)
Show SMILES COC(=O)N(CC(O)=O)Cc1cccc(OCc2coc(n2)-c2ccc(F)cc2F)c1
Show InChI InChI=1S/C21H18F2N2O6/c1-29-21(28)25(10-19(26)27)9-13-3-2-4-16(7-13)30-11-15-12-31-20(24-15)17-6-5-14(22)8-18(17)23/h2-8,12H,9-11H2,1H3,(H,26,27)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 1.09E+3n/an/an/an/a



Bristol-Myers Squibb R&D

Curated by ChEMBL


Assay Description
Agonist activity against human Gal4-fussed PPARalpha in HEK293 cells by luciferase reporter gene assay


Bioorg Med Chem Lett 20: 2933-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.019
BindingDB Entry DOI: 10.7270/Q2K35TS2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50317115
PNG
(2-((3-((2-(2,4-difluorophenyl)oxazol-4-yl)methoxy)...)
Show SMILES COC(=O)N(CC(O)=O)Cc1cccc(OCc2coc(n2)-c2ccc(F)cc2F)c1
Show InChI InChI=1S/C21H18F2N2O6/c1-29-21(28)25(10-19(26)27)9-13-3-2-4-16(7-13)30-11-15-12-31-20(24-15)17-6-5-14(22)8-18(17)23/h2-8,12H,9-11H2,1H3,(H,26,27)
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>2.50E+4n/an/an/an/a



Bristol-Myers Squibb R&D

Curated by ChEMBL


Assay Description
Agonist activity against human Gal4-fussed PPARgamma in HEK293 cells by luciferase reporter gene assay


Bioorg Med Chem Lett 20: 2933-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.019
BindingDB Entry DOI: 10.7270/Q2K35TS2
More data for this
Ligand-Target Pair