BDBM50247722 2-(3-Allyl-4-oxo-3,4,5,6,7,8-hexahydro-benzo[4,5]thieno[2,3-d]pyrimidin-2-ylsulfanyl)-N-(4-sulfamoyl-phenyl)-acetamide::CHEMBL517746

SMILES NS(=O)(=O)c1ccc(NC(=O)CSc2nc3sc4CCCCc4c3c(=O)n2CC=C)cc1

InChI Key InChIKey=VFGXLFIRGCNKSK-UHFFFAOYSA-N

Data  3 KI  1 IC50

  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 4 hits for monomerid = 50247722   

TargetBeta-secretase 1(Human)
Applied Science University

Curated by ChEMBL
LigandPNGBDBM50247722(2-(3-Allyl-4-oxo-3,4,5,6,7,8-hexahydro-benzo[4,5]t...)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of BACE1 after 2 hrs by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/20/2010
Entry Details Article
PubMed
TargetCarbonic anhydrase 2(Human)
University of Namur

Curated by ChEMBL
LigandPNGBDBM50247722(2-(3-Allyl-4-oxo-3,4,5,6,7,8-hexahydro-benzo[4,5]t...)
Affinity DataKi:  330nMAssay Description:Inhibition of human recombinant CA2 by stopped flow CO2 hydration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetCarbonic anhydrase 9(Human)
University of Namur

Curated by ChEMBL
LigandPNGBDBM50247722(2-(3-Allyl-4-oxo-3,4,5,6,7,8-hexahydro-benzo[4,5]t...)
Affinity DataKi:  2.75E+3nMAssay Description:Inhibition of human recombinant CA9 by stopped flow CO2 hydration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetCarbonic anhydrase 1(Human)
University of Namur

Curated by ChEMBL
LigandPNGBDBM50247722(2-(3-Allyl-4-oxo-3,4,5,6,7,8-hexahydro-benzo[4,5]t...)
Affinity DataKi:  1.50E+4nMAssay Description:Inhibition of human recombinant CA1 by stopped flow CO2 hydration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed