BDBM39628 (E)-2-(benzenesulfonyl)-3-(3,4-dihydroxyphenyl)-2-propenenitrile::(E)-2-(benzenesulfonyl)-3-(3,4-dihydroxyphenyl)prop-2-enenitrile::(E)-2-besyl-3-(3,4-dihydroxyphenyl)acrylonitrile::(E)-3-[3,4-bis(oxidanyl)phenyl]-2-(phenylsulfonyl)prop-2-enenitrile::3-(3,4-dihydroxyphenyl)-2-(phenylsulfonyl)acrylonitrile::MLS000050507::SMR000076437::cid_978069

SMILES Oc1ccc(\C=C(/C#N)S(=O)(=O)c2ccccc2)cc1O

InChI Key InChIKey=BNVARJNOGSWBHN-MDWZMJQESA-N

Data  3 IC50  1 EC50

  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 = 39628   

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

Curated by PubChem BioAssay
LigandPNGBDBM39628((E)-2-(benzenesulfonyl)-3-(3,4-dihydroxyphenyl)-2-...)
Affinity DataIC50:  4.10E+3nMAssay 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
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TargetM17 leucyl aminopeptidase(Plasmodium falciparum 3D7)
Srmlsc

Curated by PubChem BioAssay
LigandPNGBDBM39628((E)-2-(benzenesulfonyl)-3-(3,4-dihydroxyphenyl)-2-...)
Affinity DataIC50:  7.23E+3nMAssay Description:Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetAlkaline phosphatase, germ cell type(Homo sapiens (Human))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM39628((E)-2-(benzenesulfonyl)-3-(3,4-dihydroxyphenyl)-2-...)
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 DepthDetails PCBioAssay
TargetGenome polyprotein(Hepatitis C virus)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM39628((E)-2-(benzenesulfonyl)-3-(3,4-dihydroxyphenyl)-2-...)
Affinity DataIC50:  4.39E+3nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay