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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Platelet-activating factor acetylhydrolase' and Ligand = 'BDBM50117795'   
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
Platelet-activating factor acetylhydrolase


(Homo sapiens (Human))
BDBM50117795
PNG
(((4'-Chloro-biphenyl-4-ylmethyl)-{2-[2-(4-fluoro-b...)
Show SMILES COc1ncc(Cc2cn(CC(=O)N(CC(O)=O)Cc3ccc(cc3)-c3ccc(Cl)cc3)c(SCc3ccc(F)cc3)nc2=O)cn1
Show InChI InChI=1S/C34H29ClFN5O5S/c1-46-33-37-15-24(16-38-33)14-27-18-41(34(39-32(27)45)47-21-23-4-12-29(36)13-5-23)19-30(42)40(20-31(43)44)17-22-2-6-25(7-3-22)26-8-10-28(35)11-9-26/h2-13,15-16,18H,14,17,19-21H2,1H3,(H,43,44)
PDB
MMDB

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Similars

PubMed
n/an/a 1n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibitory concentration against Lipoprotein-Associated Phospholipase A2 (Lp-PLA2) was estimated


Bioorg Med Chem Lett 12: 2603-6 (2002)


BindingDB Entry DOI: 10.7270/Q2G44PNN
More data for this
Ligand-Target Pair