BDBM50634775 CHEMBL5557312

SMILES O=C1NCCCc2c1c1ccccc1n2CCCCCCCN1CCN(CCc2ccccc2)CC1

InChI Key

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50634775   

TargetCholinesterase(Horse)
University of Bari Aldo Moro

Curated by ChEMBL
LigandPNGBDBM50634775(CHEMBL5557312)
Affinity DataKi:  27nMAssay Description:Mixed-type inhibition of equine serum BChE using varying concentrations of butyrylthiocholine iodide as substrate assessed as inhibition constant by ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed
TargetCholinesterase(Horse)
University of Bari Aldo Moro

Curated by ChEMBL
LigandPNGBDBM50634775(CHEMBL5557312)
Affinity DataKd:  62nMAssay Description:Binding affinity to equine BChE in phosphate buffer at pH 8 assessed as equilibrium dissociation constant by SPR analysisMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed
TargetCholinesterase(Horse)
University of Bari Aldo Moro

Curated by ChEMBL
LigandPNGBDBM50634775(CHEMBL5557312)
Affinity DataIC50: 65nMAssay Description:Inhibition of equine serum BuChE using butyrylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition and measured af...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed
TargetCholinesterase(Human)
University of Bari Aldo Moro

Curated by ChEMBL
LigandPNGBDBM50634775(CHEMBL5557312)
Affinity DataIC50: 72nMAssay Description:Inhibition of human BuChE using butyrylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition and measured after 10 ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed
TargetAcetylcholinesterase(Electric eel)
University of Bari Aldo Moro

Curated by ChEMBL
LigandPNGBDBM50634775(CHEMBL5557312)
Affinity DataIC50: 5.90E+3nMAssay Description:Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition and measured afte...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed