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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for monomerid = 50197663   
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))
BDBM50197663
PNG
(CHEMBL3947621)
Show SMILES CC(C)[C@@]1(C)CN(CCOc2ccc(F)c(c2)C#N)C(=O)C1 |r|
Show InChI InChI=1S/C17H21FN2O2/c1-12(2)17(3)9-16(21)20(11-17)6-7-22-14-4-5-15(18)13(8-14)10-19/h4-5,8,12H,6-7,9,11H2,1-3H3/t17-/m1/s1
PDB
MMDB

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UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.30E+3n/an/an/an/an/an/a



Astex Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of recombinant human Lp-PLA2 incubated for 20 mins by Thio-PAF assay


J Med Chem 59: 10738-10749 (2016)


Article DOI: 10.1021/acs.jmedchem.6b01427
BindingDB Entry DOI: 10.7270/Q27946ND
More data for this
Ligand-Target Pair
Platelet-activating factor acetylhydrolase


(Homo sapiens (Human))
BDBM50197663
PNG
(CHEMBL3947621)
Show SMILES CC(C)[C@@]1(C)CN(CCOc2ccc(F)c(c2)C#N)C(=O)C1 |r|
Show InChI InChI=1S/C17H21FN2O2/c1-12(2)17(3)9-16(21)20(11-17)6-7-22-14-4-5-15(18)13(8-14)10-19/h4-5,8,12H,6-7,9,11H2,1-3H3/t17-/m1/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 6.20E+3n/an/an/an/an/an/a



Astex Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of Lp-PLA2 in whole human plasma pre-incubated for 15 mins before 2-thio-PAF substrate addition


J Med Chem 59: 10738-10749 (2016)


Article DOI: 10.1021/acs.jmedchem.6b01427
BindingDB Entry DOI: 10.7270/Q27946ND
More data for this
Ligand-Target Pair