BDBM50337805 2-(4-chloro-6-(3,5-di-tert-butylphenylamino)pyrimidin-2-ylthio)-2-(naphthalen-1-yl)acetic acid::CHEMBL1683859

SMILES CC(C)(C)c1cc(Nc2cc(Cl)nc(SC(C(O)=O)c3cccc4ccccc34)n2)cc(c1)C(C)(C)C

InChI Key InChIKey=VJGMLKIKOQLELQ-UHFFFAOYSA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50337805   

TargetPolyunsaturated fatty acid 5-lipoxygenase(Human)
Goethe-University Frankfurt

Curated by ChEMBL
LigandPNGBDBM50337805(2-(4-chloro-6-(3,5-di-tert-butylphenylamino)pyrimi...)
Affinity DataIC50: 260nMAssay Description:Inhibition of 5-lipoxygenase in human PMNLMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/24/2011
Entry Details Article
PubMed
TargetProstaglandin E synthase(Human)
Goethe-University Frankfurt

Curated by ChEMBL
LigandPNGBDBM50337805(2-(4-chloro-6-(3,5-di-tert-butylphenylamino)pyrimi...)
Affinity DataIC50: 900nMAssay Description:Inhibition of mPGES-1 expressed in LPS-stimulated human A549 cells mitochondrial fraction assessed as conversion of PGH2 to PGE2More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/24/2011
Entry Details Article
PubMed
TargetPolyunsaturated fatty acid 5-lipoxygenase(Human)
Goethe-University Frankfurt

Curated by ChEMBL
LigandPNGBDBM50337805(2-(4-chloro-6-(3,5-di-tert-butylphenylamino)pyrimi...)
Affinity DataIC50: 1.90E+3nMAssay Description:Inhibition of human recombinant 5-lipoxygenaseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/24/2011
Entry Details Article
PubMed