BDBM50507119 CHEMBL4441033

SMILES COc1cc(CN2[C@H](Cc3ccccn3)C(=O)Nc3cc(Cl)ccc3C2=O)ccc1C(=O)Nc1ccc(C)cn1

InChI Key InChIKey=DEXMPVQPCRRCQL-RUZDIDTESA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50507119   

TargetToxin B(Peptoclostridium difficile)
Venenum Biodesign

Curated by ChEMBL
LigandPNGBDBM50507119(CHEMBL4441033)
Affinity DataIC50:  9nMAssay 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
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetToxin A(Peptoclostridium difficile)
Venenum Biodesign

Curated by ChEMBL
LigandPNGBDBM50507119(CHEMBL4441033)
Affinity DataIC50:  1.10E+4nMAssay Description:Inhibition of Clostridium difficile toxin A 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
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetToxin B(Peptoclostridium difficile)
Venenum Biodesign

Curated by ChEMBL
LigandPNGBDBM50507119(CHEMBL4441033)
Affinity DataIC50:  1.90E+3nMAssay 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
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed