BDBM76382 1-(3,4-Dihydro-2H-benzo[b][1,4]dioxepin-7-yl)-3-phenyl-propan-1-one::1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-phenyl-1-propanone::1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-phenyl-propan-1-one::1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-phenylpropan-1-one::MLS000067575::SMR000115867::cid_766918

SMILES O=C(CCc1ccccc1)c1ccc2OCCCOc2c1

InChI Key InChIKey=NMQQGVOUVVSYHF-UHFFFAOYSA-N

Data  3 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 3 hits for monomerid = 76382   

TargetCaspase-3(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM76382(SMR000115867 | 1-(3,4-dihydro-2H-1,5-benzodioxepin...)
Affinity DataIC50: 2.89E+4nMAssay 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:
8/1/2011
Entry Details
PCBioAssay
TargetSentrin-specific protease 8(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM76382(SMR000115867 | 1-(3,4-dihydro-2H-1,5-benzodioxepin...)
Affinity DataIC50: 2.73E+4nMAssay 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:
8/1/2011
Entry Details
PCBioAssay
TargetSentrin-specific protease 6(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM76382(SMR000115867 | 1-(3,4-dihydro-2H-1,5-benzodioxepin...)
Affinity DataIC50: 3.28E+4nMAssay 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:
8/1/2011
Entry Details
PCBioAssay