BDBM50513323 CHEMBL4449439

SMILES Nc1nc(cc(n1)-c1ccccc1OCC#C)-c1ccc(OCC#C)cc1

InChI Key InChIKey=LFFXNDXTUARTQT-UHFFFAOYSA-N

Data  3 IC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50513323   

TargetAcetylcholinesterase(Electric eel)
Central University of Punjab

Curated by ChEMBL
LigandPNGBDBM50513323(CHEMBL4449439)
Affinity DataIC50: 1.81E+3nMAssay Description:Inhibition of electric eel AChE assessed as reduction in production of H202 using acetylcholine as substrate incubated for 15 mins followed by substr...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/21/2021
Entry Details Article
PubMed
TargetAmine oxidase [flavin-containing] B(Human)
Central University of Punjab

Curated by ChEMBL
LigandPNGBDBM50513323(CHEMBL4449439)
Affinity DataIC50: 2.21E+4nMAssay Description:Inhibition of human recombinant microsomal MAO-B expressed in baculovirus infected BTI-TN-5B1-4 cells assessed as reduction in production of H202 usi...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/21/2021
Entry Details Article
PubMed
TargetAmine oxidase [flavin-containing] A(Human)
Central University of Punjab

Curated by ChEMBL
LigandPNGBDBM50513323(CHEMBL4449439)
Affinity DataIC50: 2.86E+4nMAssay Description:Inhibition of human recombinant microsomal MAO-A expressed in baculovirus infected BTI-TN-5B1-4 cells assessed as reduction in production of H202 usi...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/21/2021
Entry Details Article
PubMed