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BDBM50229213 2-methyl-2-(4-((4-(4-methylthiazol-2-yl)benzamido)methyl)phenoxy)propanoic acid::CHEMBL253522

SMILES: Cc1csc(n1)-c1ccc(cc1)C(=O)NCc1ccc(OC(C)(C)C(O)=O)cc1

InChI Key: InChIKey=APLBIJUJEBHZMP-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 = 50229213   
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


(Mus musculus)
BDBM50229213
PNG
(2-methyl-2-(4-((4-(4-methylthiazol-2-yl)benzamido)...)
Show SMILES Cc1csc(n1)-c1ccc(cc1)C(=O)NCc1ccc(OC(C)(C)C(O)=O)cc1
Show InChI InChI=1S/C22H22N2O4S/c1-14-13-29-20(24-14)17-8-6-16(7-9-17)19(25)23-12-15-4-10-18(11-5-15)28-22(2,3)21(26)27/h4-11,13H,12H2,1-3H3,(H,23,25)(H,26,27)
PDB
MMDB

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KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a>2.50E+4n/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Agonist activity at mouse PPARalpha assessed as receptor activation by cell based assay


Bioorg Med Chem Lett 18: 710-5 (2008)


Article DOI: 10.1016/j.bmcl.2007.11.053
BindingDB Entry DOI: 10.7270/Q2542NBN
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50229213
PNG
(2-methyl-2-(4-((4-(4-methylthiazol-2-yl)benzamido)...)
Show SMILES Cc1csc(n1)-c1ccc(cc1)C(=O)NCc1ccc(OC(C)(C)C(O)=O)cc1
Show InChI InChI=1S/C22H22N2O4S/c1-14-13-29-20(24-14)17-8-6-16(7-9-17)19(25)23-12-15-4-10-18(11-5-15)28-22(2,3)21(26)27/h4-11,13H,12H2,1-3H3,(H,23,25)(H,26,27)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 5.00E+3n/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha assessed as receptor activation by cell based assay


Bioorg Med Chem Lett 18: 710-5 (2008)


Article DOI: 10.1016/j.bmcl.2007.11.053
BindingDB Entry DOI: 10.7270/Q2542NBN
More data for this
Ligand-Target Pair