BDBM50404089 CHEMBL5267972

SMILES COc1ccc2[nH]cc(CCNC(=O)CN(CCCCC3CCN(Cc4ccccc4)CC3)C(=O)c3cc(=O)c4ccccc4o3)c2c1

InChI Key InChIKey=LHSUEACWFJGZKG-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:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50404089   

TargetCholinesterase(Horse)
Jamia Millia Islamia

Curated by ChEMBL
LigandPNGBDBM50404089(CHEMBL5267972)
Affinity DataIC50: 12nMAssay Description:Inhibition of equine serum BuchE using butyrylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition and measured af...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/18/2024
Entry Details
PubMed
TargetCholinesterase(Human)
Jamia Millia Islamia

Curated by ChEMBL
LigandPNGBDBM50404089(CHEMBL5267972)
Affinity DataIC50: 12nMAssay Description:Inhibition of BuChE (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/18/2024
Entry Details
PubMed
TargetAcetylcholinesterase(Human)
Jamia Millia Islamia

Curated by ChEMBL
LigandPNGBDBM50404089(CHEMBL5267972)
Affinity DataIC50: 2.00E+3nMAssay Description:Inhibition of human AchE expressed in human HEK293 cells using acetylthiocholine as substrate preincubated for 10 mins followed by substrate addition...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/18/2024
Entry Details
PubMed
TargetAmine oxidase [flavin-containing] A(Human)
Jamia Millia Islamia

Curated by ChEMBL
LigandPNGBDBM50404089(CHEMBL5267972)
Affinity DataIC50: 3.00E+3nMAssay Description:Inhibition of human MAO-A using kynuramine as substrate preincubated for 5 mins followed by substrate addition and measured after 30 mins by spectros...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/18/2024
Entry Details
PubMed
TargetAmine oxidase [flavin-containing] B(Human)
Jamia Millia Islamia

Curated by ChEMBL
LigandPNGBDBM50404089(CHEMBL5267972)
Affinity DataIC50: 2.10E+4nMAssay Description:Inhibition of human MAO-B using kynuramine as substrate preincubated for 5 mins followed by substrate addition and measured after 30 mins by spectros...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/18/2024
Entry Details
PubMed