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BDBM50317117 (S)-2-((1-(3-((2-(4-chlorophenyl)oxazol-4-yl)methoxy)phenyl)ethyl)(methoxycarbonyl)amino)acetic acid::CHEMBL1087467

SMILES: COC(=O)N(CC(O)=O)[C@@H](C)c1cccc(OCc2coc(n2)-c2ccc(Cl)cc2)c1

InChI Key: InChIKey=WUZGKDCLUSLLOH-AWEZNQCLSA-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 = 50317117   
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 (PPAR alpha)


(Homo sapiens (Human))
BDBM50317117
PNG
((S)-2-((1-(3-((2-(4-chlorophenyl)oxazol-4-yl)metho...)
Show SMILES COC(=O)N(CC(O)=O)[C@@H](C)c1cccc(OCc2coc(n2)-c2ccc(Cl)cc2)c1 |r|
Show InChI InChI=1S/C22H21ClN2O6/c1-14(25(11-20(26)27)22(28)29-2)16-4-3-5-19(10-16)30-12-18-13-31-21(24-18)15-6-8-17(23)9-7-15/h3-10,13-14H,11-12H2,1-2H3,(H,26,27)/t14-/m0/s1
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 73n/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


(Homo sapiens (Human))
BDBM50317117
PNG
((S)-2-((1-(3-((2-(4-chlorophenyl)oxazol-4-yl)metho...)
Show SMILES COC(=O)N(CC(O)=O)[C@@H](C)c1cccc(OCc2coc(n2)-c2ccc(Cl)cc2)c1 |r|
Show InChI InChI=1S/C22H21ClN2O6/c1-14(25(11-20(26)27)22(28)29-2)16-4-3-5-19(10-16)30-12-18-13-31-21(24-18)15-6-8-17(23)9-7-15/h3-10,13-14H,11-12H2,1-2H3,(H,26,27)/t14-/m0/s1
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>8.30E+3n/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