BDBM50247874 CHEMBL4081346

SMILES CC(CCCN(C)Cc1ccc(cc1)-c1csc2ccc(cc12)C#N)Nc1ccnc2ccccc12

InChI Key InChIKey=XSSGZTGBRMFSDN-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50247874   

TargetBotulinum neurotoxin type A(Clostridium botulinum)
University of Belgrade

Curated by ChEMBL
LigandPNGBDBM50247874(CHEMBL4081346)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of Clostridium botulinum BoNT/A holotoxin-mediated SNAP-25 cleavage in mouse HBG3 cell-derived motor neurons preincubated for 30 mins foll...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/3/2019
Entry Details Article
PubMed