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Assay Detail

CHEMBL1936263

Review assay metadata, readout intent, target linkage, and publication context from the same page.

Binding
Inhibition of Clostridium botulinum BoNT/A light chain-mediated SNAP-25 substrate cleavage after 40 mins by FRET assay
29
Total Activities
29
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Clostridium botulinum
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Botulinum neurotoxin type A (CHEMBL5192)
Type SINGLE PROTEIN
Organism Clostridium botulinum

Publication

Time-dependent botulinum neurotoxin serotype A metalloprotease inhibitors.
Li B, Cardinale SC, Butler MM, Pai R, Nuss JE, Peet NP, Bavari S, Bowlin TL.
Bioorg Med Chem (2011) 19 : 7338 -7348
PubMed 22082667 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 29 4.35 5.14

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL1933865 1 5.14
CHEMBL1933882 1 4.58
CHEMBL1933884 1 4.23
CHEMBL1933871 1 4.23
CHEMBL1933874 1 4.14
CHEMBL1933873 1 4.07
CHEMBL1933872 1 4.03
CHEMBL1933880 1 -
CHEMBL116847 1 -
CHEMBL1933879 1 -
CHEMBL1933877 1 -
CHEMBL1933876 1 -
CHEMBL1933875 1 -
CHEMBL1933870 1 -
CHEMBL1933869 1 -
CHEMBL1933868 1 -
CHEMBL1933867 1 -
CHEMBL1933866 1 -
CHEMBL1933881 1 -
CHEMBL1933890 1 -
CHEMBL118009 1 -
CHEMBL1933889 1 -
CHEMBL1933883 1 -
CHEMBL116569 1 -
CHEMBL1933888 1 -
CHEMBL1933887 1 -
CHEMBL1933886 1 -
CHEMBL1933878 1 -
CHEMBL1933885 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL1933865 IC50 = 7200.0 nM 5.14
CHEMBL1933882 IC50 = 26000.0 nM 4.58
CHEMBL1933884 IC50 = 59000.0 nM 4.23
CHEMBL1933871 IC50 = 59000.0 nM 4.23
CHEMBL1933874 IC50 = 73000.0 nM 4.14
CHEMBL1933873 IC50 = 86000.0 nM 4.07
CHEMBL1933872 IC50 = 94000.0 nM 4.03
CHEMBL1933880 IC50 > 100000.0 nM -
CHEMBL116847 IC50 > 100000.0 nM -
CHEMBL1933879 IC50 > 100000.0 nM -
CHEMBL1933877 IC50 > 100000.0 nM -
CHEMBL1933876 IC50 > 100000.0 nM -
CHEMBL1933875 IC50 > 100000.0 nM -
CHEMBL1933870 IC50 > 100000.0 nM -
CHEMBL1933869 IC50 > 100000.0 nM -
CHEMBL1933868 IC50 > 100000.0 nM -
CHEMBL1933867 IC50 > 100000.0 nM -
CHEMBL1933866 IC50 > 100000.0 nM -
CHEMBL1933881 IC50 > 100000.0 nM -
CHEMBL1933890 IC50 > 100000.0 nM -
CHEMBL118009 IC50 > 100000.0 nM -
CHEMBL1933889 IC50 > 100000.0 nM -
CHEMBL1933883 IC50 > 100000.0 nM -
CHEMBL116569 IC50 > 100000.0 nM -
CHEMBL1933888 IC50 > 100000.0 nM -
CHEMBL1933887 IC50 > 100000.0 nM -
CHEMBL1933886 IC50 > 100000.0 nM -
CHEMBL1933878 IC50 > 100000.0 nM -
CHEMBL1933885 IC50 > 100000.0 nM -