BDBM50507114 CHEMBL4553525

SMILES Clc1ccc2c(NC(=O)[C@@H](Cc3ccccn3)N(Cc3ccc(C(=O)Nc4ccc(cn4)C#N)c(Cl)c3)C2=O)c1

InChI Key InChIKey=SKCIAHPLJDFJPS-UHFFFAOYSA-N

Data  2 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 = 50507114   

TargetToxin B(Peptoclostridium difficile)
Venenum Biodesign

Curated by ChEMBL
LigandPNGBDBM50507114(CHEMBL4553525)
Affinity DataIC50: 8nMAssay Description:Inhibition of C-terminal 6-His tagged recombinant Clostridium difficile toxin B glucosyltransferase domain assessed as reduction in UDP-glucose hydro...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/19/2021
Entry Details Article
PubMed
TargetToxin B(Peptoclostridium difficile)
Venenum Biodesign

Curated by ChEMBL
LigandPNGBDBM50507114(CHEMBL4553525)
Affinity DataIC50: 52nMAssay Description:Inhibition of Clostridium difficile toxin B transfected in CHO cells assessed as reduction in caspase 3/7 activation pre-incubated for 1 hr before Tc...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/19/2021
Entry Details Article
PubMed