BDBM50005563 CHEMBL3234587::CHEMBL434456

SMILES O\N=C\c1nc(CCCCCNc2c3CCCCc3nc3ccccc23)ccc1O

InChI Key InChIKey=KSMHDBPIJWXMSI-UHFFFAOYSA-N

Data  1 IC50  3 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 = 50005563   

TargetAcetylcholinesterase(Human)
University of Strasburg

Curated by ChEMBL
LigandPNGBDBM50005563(CHEMBL434456 | CHEMBL3234587)
Affinity DataKd:  4.10E+4nMAssay Description:Reactivation of methylphosphonothioate VX-inhibited recombinant human AChE measured up to 10 mins by Ellman's methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/7/2015
Entry Details Article
PubMed
TargetAcetylcholinesterase(Human)
University of Strasburg

Curated by ChEMBL
LigandPNGBDBM50005563(CHEMBL434456 | CHEMBL3234587)
Affinity DataKd:  3.00E+4nMAssay Description:Reactivation of tabun-inhibited recombinant human AChE measured up to 10 mins by Ellman's methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/7/2015
Entry Details Article
PubMed
TargetAcetylcholinesterase(Human)
University of Strasburg

Curated by ChEMBL
LigandPNGBDBM50005563(CHEMBL434456 | CHEMBL3234587)
Affinity DataKd:  1.10E+3nMAssay Description:Reactivation of paraoxon-inhibited recombinant human AChE measured up to 10 mins by Ellman's methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/7/2015
Entry Details Article
PubMed
TargetAcetylcholinesterase(Human)
University of Strasburg

Curated by ChEMBL
LigandPNGBDBM50005563(CHEMBL434456 | CHEMBL3234587)
Affinity DataIC50: 260nMAssay Description:Inhibition of recombinant human AChE by Ellman's methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/7/2015
Entry Details Article
PubMed