BDBM50449750 CHEMBL4164310

SMILES Nc1c2CCCCc2nc2NC(=S)NC(c3cccc(c3)[N+]([O-])=O)c12

InChI Key InChIKey=AJVJINJDKFGAQT-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 50449750   

TargetCholinesterase(Human)
Laboratory of Medicinal Chemistry (Iqog, Csic)

Curated by ChEMBL
LigandPNGBDBM50449750(CHEMBL4164310)
Affinity DataIC50: 2.68E+3nMAssay Description:Inhibition of recombinant human serum BChE using butyrylthiocholine as substrate pretreated for 20 mins followed by substrate addition by Ellman's me...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/15/2020
Entry Details Article
PubMed
TargetAcetylcholinesterase(Human)
Laboratory of Medicinal Chemistry (Iqog, Csic)

Curated by ChEMBL
LigandPNGBDBM50449750(CHEMBL4164310)
Affinity DataIC50: 2.98E+4nMAssay Description:Inhibition of recombinant human AChE expressed in HEK293 cells using acetylthiocholine as substrate pretreated for 20 mins followed by substrate addi...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/15/2020
Entry Details Article
PubMed