BDBM42256 (E)-2-(2-isoquinolin-2-iumyl)-3-oxo-1,3-diphenyl-1-propen-1-olate::(E)-2-isoquinolin-2-ium-2-yl-3-keto-1,3-diphenyl-prop-1-en-1-olate::(E)-2-isoquinolin-2-ium-2-yl-3-oxidanylidene-1,3-diphenyl-prop-1-en-1-olate::(E)-2-isoquinolin-2-ium-2-yl-3-oxo-1,3-diphenylprop-1-en-1-olate::2-(2-isoquinoliniumyl)-3-oxo-1,3-diphenyl-1-propen-1-olate::MLS000705899::SMR000230196::cid_6263631

SMILES O=C([C-](C(=O)c1ccccc1)[n+]1ccc2ccccc2c1)c1ccccc1

InChI Key InChIKey=QXQFLINFPGWSIH-UHFFFAOYSA-N

Data  4 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 42256   

TargetTyrosine-protein phosphatase YopH(Yersinia enterocolitica)
University of Pittsburgh

Curated by PubChem BioAssay
LigandPNGBDBM42256(cid_6263631 | SMR000230196 | (E)-2-isoquinolin-2-i...)
Affinity DataIC50: 5.00E+4nMAssay Description:Yersinia pestis is the causal agent of the bubonic plague and, although modern antibiotics are extremely effective against the malady, the plague rem...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/20/2011
Entry Details
PCBioAssay
TargetTyrosine-protein phosphatase YopH(Yersinia enterocolitica)
University of Pittsburgh

Curated by PubChem BioAssay
LigandPNGBDBM42256(cid_6263631 | SMR000230196 | (E)-2-isoquinolin-2-i...)
Affinity DataIC50: 5.00E+4nMAssay Description:Yersinia pestis is the causal agent of the bubonic plague and, although modern antibiotics are extremely effective against the malady, the plague rem...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/20/2011
Entry Details
PCBioAssay
TargetTyrosine-protein phosphatase YopH(Yersinia enterocolitica)
University of Pittsburgh

Curated by PubChem BioAssay
LigandPNGBDBM42256(cid_6263631 | SMR000230196 | (E)-2-isoquinolin-2-i...)
Affinity DataIC50: 5.00E+4nMAssay Description:Yersinia pestis is the causal agent of the bubonic plague and, although modern antibiotics are extremely effective against the malady, the plague rem...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/20/2011
Entry Details
PCBioAssay
TargetGlycoprotein 42(HHV-4)
Emory University

Curated by PubChem BioAssay
LigandPNGBDBM42256(cid_6263631 | SMR000230196 | (E)-2-isoquinolin-2-i...)
Affinity DataIC50: 2.88E+3nMAssay Description:NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Theodore Jardetzky; Northw...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/30/2011
Entry Details
PCBioAssay