BDBM50025010 CHEMBL116379

SMILES NC(=O)c2cc[n+](CCCC[n+]1ccc(/C=N/O)cc1)cc2

InChI Key InChIKey=KMFIVIQDYRPBBJ-UHFFFAOYSA-P

Data  3 KI  1 Kd

  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 4 hits for monomerid = 50025010   

TargetAcetylcholinesterase(Human)
Pt. Ravishankar Shukla University

Curated by ChEMBL
LigandPNGBDBM50025010(CHEMBL116379)
Affinity DataKd:  3.87E+4nMAssay Description:Binding affinity to paraoxon-inhibited AChE (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/6/2016
Entry Details Article
PubMed
TargetAcetylcholinesterase(Human)
Pt. Ravishankar Shukla University

Curated by ChEMBL
LigandPNGBDBM50025010(CHEMBL116379)
Affinity DataKi:  1.10E+5nMAssay Description:Reactivation of OP compound induced inhibition of AChE in human erythrocytes using ATCh as substrate measured up to 2 mins by Ellman's methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/20/2023
Entry Details
PubMed
TargetAcetylcholinesterase(Human)
Pt. Ravishankar Shukla University

Curated by ChEMBL
LigandPNGBDBM50025010(CHEMBL116379)
Affinity DataKi:  1.10E+5nMAssay Description:Reversible inhibition of human erythrocytic AChE using acetylthiocholine iodide as substrate measured up to 2 mins by spectrophotometric methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/18/2020
Entry Details Article
PubMed
TargetCholinesterase(Human)
Institute For Medical Research and Occupational Health

Curated by ChEMBL
LigandPNGBDBM50025010(CHEMBL116379)
Affinity DataKi:  4.20E+5nMAssay Description:Reactivation of tabun induced inhibition of BChE in human plasma using ATCh as substrate by Ellman's methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/20/2023
Entry Details
PubMed