BDBM50513225 CHEMBL4527805

SMILES COc1ccc(\C=C2/COc3cc(OCCCN4CCCCC4)ccc3C2=O)cc1

InChI Key InChIKey=ITHOQDYOXKNLHE-UHFFFAOYSA-N

Data  5 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50513225   

TargetAcetylcholinesterase(Electric eel)
China Pharmaceutical University

Curated by ChEMBL
LigandPNGBDBM50513225(CHEMBL4527805)
Affinity DataIC50: 3.94E+3nMAssay Description:Inhibition of electric eel AChE using acetylthiocholine chloride as substrate preincubated for 15 mins followed by substrate additionMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/21/2021
Entry Details Article
PubMed
TargetAmine oxidase [flavin-containing] B(Human)
China Pharmaceutical University

Curated by ChEMBL
LigandPNGBDBM50513225(CHEMBL4527805)
Affinity DataIC50: 3.44E+3nMAssay Description:Inhibition of human MAOB using benzylamine as substrate preincubated fore 15 mins followed by substrate addition measured after 20 mins by fluorescen...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/21/2021
Entry Details Article
PubMed
TargetAcetylcholinesterase(Human)
Tehran University of Medical Sciences

Curated by ChEMBL
LigandPNGBDBM50513225(CHEMBL4527805)
Affinity DataIC50: 3.94E+3nMAssay Description:Inhibition of AChE (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/22/2024
Entry Details
PubMed
TargetCholinesterase(Human)
Tehran University of Medical Sciences

Curated by ChEMBL
LigandPNGBDBM50513225(CHEMBL4527805)
Affinity DataIC50: 9.21E+3nMAssay Description:Inhibition of BuChE (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/22/2024
Entry Details
PubMed
TargetAmine oxidase [flavin-containing] B(Human)
China Pharmaceutical University

Curated by ChEMBL
LigandPNGBDBM50513225(CHEMBL4527805)
Affinity DataIC50: 3.44E+3nMAssay Description:Inhibition of human MAO-BMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/22/2024
Entry Details
PubMed