BDBM50429172 CHEMBL2336713

SMILES COc1ccc(cc1)C12CC3CC(CC(CC(=O)NO)(C3)C1)C2

InChI Key InChIKey=PAOMPJTZWNBUGT-UHFFFAOYSA-N

Data  1 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 2 hits for monomerid = 50429172   

TargetBotulinum neurotoxin type A(Clostridium botulinum)
The Scripps Research Institute

Curated by ChEMBL
LigandPNGBDBM50429172(CHEMBL2336713)
Affinity DataKi:  130nMAssay Description:Competitive inhibition of Clostridium botulinum BoNT/A Hall A hyper protease light chain (1-425aa) using SNAP-66mer (141-206aa) as substrate by FRET ...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetBotulinum neurotoxin type A(Clostridium botulinum)
The Scripps Research Institute

Curated by ChEMBL
LigandPNGBDBM50429172(CHEMBL2336713)
Affinity DataIC50:  250nMAssay Description:Inhibition of Clostridium botulinum BoNT/A Hall A hyper protease light chain (1-425aa) using SNAPtide as substrate by FRET assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed