BDBM50505208 CHEMBL3311040

SMILES COc1ccc(cc1OC)-c1coc2c3C=CC(C)(C)Oc3ccc2c1=O

InChI Key InChIKey=BRFOUIGDZGRCOL-UHFFFAOYSA-N

Data  1 KI  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50505208   

TargetCholinesterase(Human)
Sichuan University

Curated by ChEMBL
LigandPNGBDBM50505208(CHEMBL3311040)
Affinity DataIC50: 2.34E+3nMAssay Description:Inhibition of BChE (unknown origin) using butyrylthiocholine iodide as substrate by spectrophotometry based Ellman's methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/18/2021
Entry Details Article
PubMed
TargetCholinesterase(Human)
Sichuan University

Curated by ChEMBL
LigandPNGBDBM50505208(CHEMBL3311040)
Affinity DataIC50: 7.82E+3nMAssay Description:Binding affinity to BChE (unknown origin) assessed as reduction in intrinsic protein fluorescence at 25 degC by fluorescence spectrophotometryMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/18/2021
Entry Details Article
PubMed
TargetAcetylcholinesterase(Human)
Sichuan University

Curated by ChEMBL
LigandPNGBDBM50505208(CHEMBL3311040)
Affinity DataIC50: 1.31E+5nMAssay Description:Inhibition of AChE (unknown origin) using acetylthiocholine iodide as substrate by spectrophotometry based Ellman's methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/18/2021
Entry Details Article
PubMed
TargetCholinesterase(Human)
Sichuan University

Curated by ChEMBL
LigandPNGBDBM50505208(CHEMBL3311040)
Affinity DataKi:  920nMAssay Description:Mixed type inhibition of BChE (unknown origin) using butyrylthiocholine iodide as substrate by Ellman's method based Lineweaver-Burk plot analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/18/2021
Entry Details Article
PubMed