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Compile Data Set for Download or QSAR

Found 3 hits of ic50 for monomerid = 50197674   
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))
BDBM50197674
PNG
(CHEMBL3933361)
Show SMILES OC=O.CC1(CCNCC1)C1CN(CCOc2ccc(F)c(c2)C#N)C(=O)C1
Show InChI InChI=1S/C19H24FN3O2.CH2O2/c1-19(4-6-22-7-5-19)15-11-18(24)23(13-15)8-9-25-16-2-3-17(20)14(10-16)12-21;2-1-3/h2-3,10,15,22H,4-9,11,13H2,1H3;1H,(H,2,3)
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Article
PubMed
n/an/a 620n/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))
BDBM50197674
PNG
(CHEMBL3933361)
Show SMILES OC=O.CC1(CCNCC1)C1CN(CCOc2ccc(F)c(c2)C#N)C(=O)C1
Show InChI InChI=1S/C19H24FN3O2.CH2O2/c1-19(4-6-22-7-5-19)15-11-18(24)23(13-15)8-9-25-16-2-3-17(20)14(10-16)12-21;2-1-3/h2-3,10,15,22H,4-9,11,13H2,1H3;1H,(H,2,3)
PDB
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PC sid
UniChem

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Article
PubMed
n/an/a 620n/an/an/an/an/an/a



Astex Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of recombinant human Lp-PLA2 pre-incubated for 30 mins before PED6 fluorogenic substrate


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))
BDBM50197674
PNG
(CHEMBL3933361)
Show SMILES OC=O.CC1(CCNCC1)C1CN(CCOc2ccc(F)c(c2)C#N)C(=O)C1
Show InChI InChI=1S/C19H24FN3O2.CH2O2/c1-19(4-6-22-7-5-19)15-11-18(24)23(13-15)8-9-25-16-2-3-17(20)14(10-16)12-21;2-1-3/h2-3,10,15,22H,4-9,11,13H2,1H3;1H,(H,2,3)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
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antibodypedia
GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 870n/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