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BDBM50264537 (S)-3-(3-(5-Benzyl-4,5-dihydroisoxazol-3-yl)phenyl)-2-ethoxypropanoicAcid::CHEMBL484063

SMILES: CCO[C@@H](Cc1cccc(c1)C1=NOC(Cc2ccccc2)C1)C(O)=O

InChI Key: InChIKey=RMJMVMTVRSFGAV-IJHRGXPZSA-N

Data: 2 EC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50264537   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50264537
PNG
((S)-3-(3-(5-Benzyl-4,5-dihydroisoxazol-3-yl)phenyl...)
Show SMILES CCO[C@@H](Cc1cccc(c1)C1=NOC(Cc2ccccc2)C1)C(O)=O
Show InChI InChI=1S/C21H23NO4/c1-2-25-20(21(23)24)13-16-9-6-10-17(11-16)19-14-18(26-22-19)12-15-7-4-3-5-8-15/h3-11,18,20H,2,12-14H2,1H3,(H,23,24)/t18?,20-/m0/s1
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PC cid
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Similars

Article
PubMed
n/an/an/an/a 2.16E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha ligand binding domain expressed in african green monkey CV1 cells co-transfected with fused Gal4-DBD by transacti...


J Med Chem 51: 6318-33 (2008)


Article DOI: 10.1021/jm8003416
BindingDB Entry DOI: 10.7270/Q2SQ919V
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50264537
PNG
((S)-3-(3-(5-Benzyl-4,5-dihydroisoxazol-3-yl)phenyl...)
Show SMILES CCO[C@@H](Cc1cccc(c1)C1=NOC(Cc2ccccc2)C1)C(O)=O
Show InChI InChI=1S/C21H23NO4/c1-2-25-20(21(23)24)13-16-9-6-10-17(11-16)19-14-18(26-22-19)12-15-7-4-3-5-8-15/h3-11,18,20H,2,12-14H2,1H3,(H,23,24)/t18?,20-/m0/s1
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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 6.93E+3n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma ligand binding domain expressed in african green monkey CV1 cells co-transfected with fused Gal4-DBD by transacti...


J Med Chem 51: 6318-33 (2008)


Article DOI: 10.1021/jm8003416
BindingDB Entry DOI: 10.7270/Q2SQ919V
More data for this
Ligand-Target Pair