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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 = 'BDBM50125273'   
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))
BDBM50125273
PNG
(2-[5-(2-Acetylamino-ethyl)-2-(4-fluoro-benzylsulfa...)
Show SMILES CCN(CC)CCN(Cc1ccc(cc1)-c1ccc(cc1)C(F)(F)F)C(=O)Cn1cc(CCNC(C)=O)c(=O)nc1SCc1ccc(F)cc1
Show InChI InChI=1S/C37H41F4N5O3S/c1-4-44(5-2)20-21-45(22-27-6-10-29(11-7-27)30-12-14-32(15-13-30)37(39,40)41)34(48)24-46-23-31(18-19-42-26(3)47)35(49)43-36(46)50-25-28-8-16-33(38)17-9-28/h6-17,23H,4-5,18-22,24-25H2,1-3H3,(H,42,47)
PDB
MMDB

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Similars

PubMed
n/an/a 6n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibitory activity against recombinant human Lp-PLA2


Bioorg Med Chem Lett 13: 1067-70 (2003)


BindingDB Entry DOI: 10.7270/Q2S75FPD
More data for this
Ligand-Target Pair