BindingDB logo
myBDB logout

BDBM50462441 CHEMBL1565327

SMILES: Cc1c(Cl)ccc2c(cc(nc12)-c1ccccc1)C(O)=O

InChI Key: InChIKey=ZVEMFXOLQBHHKA-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 = 50462441   
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


(Homo sapiens (Human))
BDBM50462441
PNG
(CHEMBL1565327)
Show SMILES Cc1c(Cl)ccc2c(cc(nc12)-c1ccccc1)C(O)=O
Show InChI InChI=1S/C17H12ClNO2/c1-10-14(18)8-7-12-13(17(20)21)9-15(19-16(10)12)11-5-3-2-4-6-11/h2-9H,1H3,(H,20,21)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
Purchase

MCE
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 5.24E+4n/an/an/an/a



University of Oklahoma

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha after 22 to 24 hrs by luciferase reporter gene assay


Bioorg Med Chem Lett 28: 2717-2722 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.010
BindingDB Entry DOI: 10.7270/Q24F1TCK
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50462441
PNG
(CHEMBL1565327)
Show SMILES Cc1c(Cl)ccc2c(cc(nc12)-c1ccccc1)C(O)=O
Show InChI InChI=1S/C17H12ClNO2/c1-10-14(18)8-7-12-13(17(20)21)9-15(19-16(10)12)11-5-3-2-4-6-11/h2-9H,1H3,(H,20,21)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
Purchase

MCE
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 2.50E+4n/an/an/an/a



University of Oklahoma

Curated by ChEMBL


Assay Description
Agonist activity at PPARalpha (unknown origin) expressed in reporter combo cells after 36 hrs by dual luciferase reporter gene assay


Bioorg Med Chem Lett 28: 2717-2722 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.010
BindingDB Entry DOI: 10.7270/Q24F1TCK
More data for this
Ligand-Target Pair