BDBM87462 3-[(1-oxidopyridin-1-ium-3-carbonyl)amino]benzoic acid methyl ester::3-[[(1-oxido-3-pyridin-1-iumyl)-oxomethyl]amino]benzoic acid methyl ester::MLS001008560::SMR000495833::cid_47522::methyl 3-[(1-oxidanidylpyridin-1-ium-3-yl)carbonylamino]benzoate::methyl 3-[(1-oxidopyridin-1-ium-3-carbonyl)amino]benzoate::methyl 3-{[(1-oxido-3-pyridinyl)carbonyl]amino}benzoate

SMILES COC(=O)c1cccc(NC(=O)c2ccc[n+]([O-])c2)c1

InChI Key InChIKey=YFXGLUHJHWNAGZ-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 = 87462   

TargetTyrosine-protein kinase ABL1(Homo sapiens (Human))
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM87462(3-[(1-oxidopyridin-1-ium-3-carbonyl)amino]benzoic ...)
Affinity DataIC50:  1.80E+4nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay