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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Peroxisome proliferator-activated receptor delta' and Ligand = 'BDBM50124370'   
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 delta


(Homo sapiens (Human))
BDBM50124370
PNG
(CHEMBL173409 | {3-[4-(3-Phenyl-7-propyl-benzo[d]is...)
Show SMILES CCCc1c(OCCCCOc2cccc(OCC(O)=O)c2)ccc2c(noc12)-c1ccccc1
Show InChI InChI=1S/C28H29NO6/c1-2-9-23-25(15-14-24-27(29-35-28(23)24)20-10-4-3-5-11-20)33-17-7-6-16-32-21-12-8-13-22(18-21)34-19-26(30)31/h3-5,8,10-15,18H,2,6-7,9,16-17,19H2,1H3,(H,30,31)
PDB

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
47n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human peroxisome proliferator activated receptor delta (PPAR delta)


Bioorg Med Chem Lett 13: 931-5 (2003)


BindingDB Entry DOI: 10.7270/Q2HX1C1Z
More data for this
Ligand-Target Pair