BDBM46554 (2Z)-2-(3H-1,3-benzothiazol-2-ylidene)-3-keto-4-(p-tolylthio)butyronitrile::(2Z)-2-(3H-1,3-benzothiazol-2-ylidene)-4-(4-methylphenyl)sulfanyl-3-oxidanylidene-butanenitrile::(2Z)-2-(3H-1,3-benzothiazol-2-ylidene)-4-(4-methylphenyl)sulfanyl-3-oxobutanenitrile::(2Z)-2-(3H-1,3-benzothiazol-2-ylidene)-4-[(4-methylphenyl)thio]-3-oxobutanenitrile::2-(1,3-benzothiazol-2(3H)-ylidene)-4-[(4-methylphenyl)thio]-3-oxobutanenitrile::MLS000096789::SMR000074118::cid_5559718

SMILES Cc1ccc(SCC(=O)C(C#N)c2nc3ccccc3s2)cc1

InChI Key InChIKey=NXGJVLBHMXPRBZ-UHFFFAOYSA-N

Data  2 IC50  1 EC50

  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 3 hits for monomerid = 46554   

TargetTransitional endoplasmic reticulum ATPase(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM46554((2Z)-2-(3H-1,3-benzothiazol-2-ylidene)-4-(4-methyl...)
Affinity DataIC50: 5.00E+4nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute (TSRI) Assay...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/28/2011
Entry Details
PCBioAssay
TargetTransitional endoplasmic reticulum ATPase(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM46554((2Z)-2-(3H-1,3-benzothiazol-2-ylidene)-4-(4-methyl...)
Affinity DataIC50: 5.00E+4nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute (TSRI) Assay...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/28/2011
Entry Details
PCBioAssay
TargetStreptokinase A(Streptococcus pyogenes M1 GAS)
Broad Institute

Curated by PubChem BioAssay
LigandPNGBDBM46554((2Z)-2-(3H-1,3-benzothiazol-2-ylidene)-4-(4-methyl...)
Affinity DataEC50:  1.50E+5nMAssay Description:Keywords: Group A streptococcus, GAS, streptokinase, expression, virulence, inhibition, dose response, EC50 Assay Overview: The goal of this assa...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/8/2011
Entry Details
PCBioAssay