BDBM34799 5-[(2,5-dimethyl-1-pyridin-3-yl-pyrrol-3-yl)methylidene]-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione::5-[(2,5-dimethyl-1-pyridin-3-ylpyrrol-3-yl)methylidene]-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione::5-[[2,5-dimethyl-1-(3-pyridinyl)-3-pyrrolyl]methylidene]-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione::5-[[2,5-dimethyl-1-(3-pyridyl)pyrrol-3-yl]methylene]-1,3-dimethyl-2-thioxo-hexahydropyrimidine-4,6-quinone::5-{[2,5-dimethyl-1-(3-pyridinyl)-1H-pyrrol-3-yl]methylene}-1,3-dimethyl-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione::MLS000665354::SMR000270457::cid_1319898

SMILES [#6]-[#7]-1-[#6](=S)-[#7](-[#6])-[#6](=O)\[#6](=[#6]\c2cc(-[#6])n(c2-[#6])-c2cccnc2)-[#6]-1=O

InChI Key InChIKey=GWBIDCHYCUUZJT-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 34799   

TargetMannose-6-phosphate isomerase(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM34799(MLS000665354 | 5-[(2,5-dimethyl-1-pyridin-3-yl-pyr...)
Affinity DataIC50: 5.00E+4nMpH: 7.4 T: 2°CAssay Description:The purpose of this assay is to identify non-competititve inhibitors of human PMI. This is accomplished by using a G6PD- NADPH-coupled assay. In the ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/24/2009
Entry Details
PCBioAssay