BDBM80912 2-[(5-acetyl-2-ethoxy-benzyl)thio]-3-allyl-quinazolin-4-one::2-[(5-acetyl-2-ethoxyphenyl)methylsulfanyl]-3-prop-2-enylquinazolin-4-one::2-[(5-acetyl-2-ethoxyphenyl)methylthio]-3-prop-2-enyl-4-quinazolinone::2-[(5-ethanoyl-2-ethoxy-phenyl)methylsulfanyl]-3-prop-2-enyl-quinazolin-4-one::MLS000389303::SMR000255576::cid_2079716

SMILES CCOc1ccc(cc1CSc1nc2ccccc2c(=O)n1CC=C)C(C)=O

InChI Key InChIKey=IQCUDURPNYATEH-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 80912   

TargetCysteine protease ATG4B(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM80912(2-[(5-ethanoyl-2-ethoxy-phenyl)methylsulfanyl]-3-p...)
Affinity DataIC50: 5.10E+3nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/3/2011
Entry Details
PCBioAssay
TargetPhospholipase A2(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM80912(2-[(5-ethanoyl-2-ethoxy-phenyl)methylsulfanyl]-3-p...)
Affinity DataIC50: 1.30E+3nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/5/2012
Entry Details
PCBioAssay