BDBM50657856 CHEMBL6196053

SMILES S=C(N/N=C/c1ccccc1)Nc1c2ccccc2nc2ccccc12

InChI Key InChIKey=FWJRWXDDRODYHP-UHFFFAOYSA-N

Data  3 KI  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 5 hits for monomerid = 50657856   

TargetCholinesterase(Horse)
Universidade Federal Rural do Rio de Janeiro

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50657856BDBM50657856(CHEMBL6196053)
Affinity DataIC50: 710nMAssay Description:Inhibition of equine serum BChE using butyrylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition by Ellman's meth...More data for this Ligand-Target Pair
Ligand Info
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
TargetCholinesterase(Horse)
Universidade Federal Rural do Rio de Janeiro

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50657856BDBM50657856(CHEMBL6196053)
Affinity DataKi:  720nMAssay Description:Competitive inhibition of equine serum BChE using butyrylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition by L...More data for this Ligand-Target Pair
Ligand Info
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
TargetAcetylcholinesterase(Electric eel)
Universidade Federal Rural do Rio de Janeiro

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50657856BDBM50657856(CHEMBL6196053)
Affinity DataKi:  1.35E+3nMAssay Description:Non-competitive inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition b...More data for this Ligand-Target Pair
Ligand Info
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
TargetCholinesterase(Horse)
Universidade Federal Rural do Rio de Janeiro

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50657856BDBM50657856(CHEMBL6196053)
Affinity DataKi:  1.68E+3nMAssay Description:Non-competitive inhibition of equine serum BChE using butyrylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition ...More data for this Ligand-Target Pair
Ligand Info
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
TargetAcetylcholinesterase(Electric eel)
Universidade Federal Rural do Rio de Janeiro

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50657856BDBM50657856(CHEMBL6196053)
Affinity DataIC50: 2.47E+3nMAssay Description:Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition by Ellman's metho...More data for this Ligand-Target Pair
Ligand Info
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed