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BDBM50062524 CHEMBL3397552

SMILES: CCCO\N=C\c1ccc(O[C@@H](Cc2ccccc2)C(O)=O)cc1

InChI Key: InChIKey=IWSCXGUAATYWAZ-OFBHVFLISA-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 = 50062524   
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))
BDBM50062524
PNG
(CHEMBL3397552)
Show SMILES CCCO\N=C\c1ccc(O[C@@H](Cc2ccccc2)C(O)=O)cc1 |r|
Show InChI InChI=1S/C19H21NO4/c1-2-12-23-20-14-16-8-10-17(11-9-16)24-18(19(21)22)13-15-6-4-3-5-7-15/h3-11,14,18H,2,12-13H2,1H3,(H,21,22)/b20-14+/t18-/m0/s1
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 3.80E+3n/an/an/an/a



Universit£ degli Studi di Bari 'Aldo Moro'

Curated by ChEMBL


Assay Description
Agonist activity at GAL4-DNA binding domain fused human PPARgamma ligand binding domain expressed in human HepG2 cells assessed as receptor transacti...


Eur J Med Chem 90: 583-94 (2015)


Article DOI: 10.1016/j.ejmech.2014.11.044
BindingDB Entry DOI: 10.7270/Q2377BD4
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50062524
PNG
(CHEMBL3397552)
Show SMILES CCCO\N=C\c1ccc(O[C@@H](Cc2ccccc2)C(O)=O)cc1 |r|
Show InChI InChI=1S/C19H21NO4/c1-2-12-23-20-14-16-8-10-17(11-9-16)24-18(19(21)22)13-15-6-4-3-5-7-15/h3-11,14,18H,2,12-13H2,1H3,(H,21,22)/b20-14+/t18-/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 3.80E+3n/an/an/an/a



Universit£ degli Studi di Bari 'Aldo Moro'

Curated by ChEMBL


Assay Description
Agonist activity at GAL4-DNA binding domain fused human PPARalpha ligand binding domain expressed in human HepG2 cells assessed as receptor transacti...


Eur J Med Chem 90: 583-94 (2015)


Article DOI: 10.1016/j.ejmech.2014.11.044
BindingDB Entry DOI: 10.7270/Q2377BD4
More data for this
Ligand-Target Pair