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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Peroxisome proliferator-activated receptor alpha' and Ligand = 'BDBM50510093'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50510093
PNG
(CHEMBL4466552)
Show SMILES COC(=O)C(OC(=O)C(\C)=C\CC\C(C)=C\CC[C@]1(C)CCc2cc(OC)cc(C)c2O1)C(=O)OC |r|
Show InChI InChI=1S/C28H38O8/c1-18(10-8-12-19(2)25(29)35-24(26(30)33-6)27(31)34-7)11-9-14-28(4)15-13-21-17-22(32-5)16-20(3)23(21)36-28/h11-12,16-17,24H,8-10,13-15H2,1-7H3/b18-11+,19-12+/t28-/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 1.62E+3n/an/an/an/a



University of Valencia

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha expressed in African green monkey COS7 cells assessed as increase in receptor transcriptional activity by lucifer...


J Nat Prod 82: 1802-1812 (2019)


Article DOI: 10.1021/acs.jnatprod.9b00003
BindingDB Entry DOI: 10.7270/Q2ZW1Q7G
More data for this
Ligand-Target Pair