BDBM39706 (phenylmethyl) 2-[[4-cyano-3-(2-oxidanylidene-2-phenylmethoxy-ethyl)sulfanyl-1,2-thiazol-5-yl]sulfanyl]ethanoate::2-[[3-[(2-benzoxy-2-keto-ethyl)thio]-4-cyano-isothiazol-5-yl]thio]acetic acid benzyl ester::2-[[4-cyano-3-[(2-oxo-2-phenylmethoxyethyl)thio]-5-isothiazolyl]thio]acetic acid (phenylmethyl) ester::MLS000537032::SMR000143669::benzyl 2-[[4-cyano-3-(2-oxo-2-phenylmethoxyethyl)sulfanyl-1,2-thiazol-5-yl]sulfanyl]acetate::cid_1963301::dibenzyl 2,2'-[(4-cyano-3,5-isothiazolediyl)bis(thio)]diacetate

SMILES O=C(CSc1nsc(SCC(=O)OCc2ccccc2)c1C#N)OCc1ccccc1

InChI Key InChIKey=FESKORARFOGMKM-UHFFFAOYSA-N

Data  1 IC50  1 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 39706   

TargetAlkaline phosphatase, germ cell type(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 39706BDBM39706(benzyl 2-[[4-cyano-3-(2-oxo-2-phenylmethoxyethyl)s...)
Affinity DataIC50: 6.29E+4nMAssay Description:Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/30/2011
Entry Details
PCBioAssay
TargetAlkaline phosphatase, germ cell type(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 39706BDBM39706(benzyl 2-[[4-cyano-3-(2-oxo-2-phenylmethoxyethyl)s...)
Affinity DataEC50:  9.99E+5nMAssay Description:Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/8/2011
Entry Details
PCBioAssay