BDBM34661 2-(1-Cyclopropanecarbonyl-2,2-dimethyl-3-thioxo-2,3-dihydro-1H-quinolin-4-ylidene)-[1,3]dithiole-4,5-dicarboxylic acid dimethyl ester::2-[1-(cyclopropanecarbonyl)-2,2-dimethyl-3-thioxo-4-quinolylidene]-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester::2-[1-[cyclopropyl(oxo)methyl]-2,2-dimethyl-3-sulfanylidene-4-quinolinylidene]-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester::MLS000525785::SMR000116259::cid_3127088::dimethyl 2-(1-cyclopropylcarbonyl-2,2-dimethyl-3-sulfanylidene-quinolin-4-ylidene)-1,3-dithiole-4,5-dicarboxylate::dimethyl 2-[1-(cyclopropanecarbonyl)-2,2-dimethyl-3-sulfanylidenequinolin-4-ylidene]-1,3-dithiole-4,5-dicarboxylate

SMILES [#6]-[#8]-[#6](=O)-[#6]-1=[#6](-[#16]\[#6](-[#16]-1)=[#6]-1/[#6](=S)C([#6])([#6])[#7](-[#6](=O)-[#6]-2-[#6]-[#6]-2)-c2ccccc-12)-[#6](=O)-[#8]-[#6]

InChI Key InChIKey=IWWUFJULUWWUHC-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 = 34661   

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

Curated by PubChem BioAssay
LigandPNGBDBM34661(SMR000116259 | dimethyl 2-(1-cyclopropylcarbonyl-2...)
Affinity DataIC50: 6.47E+3nMpH: 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