BDBM50585934 CHEMBL5082824

SMILES CN(CCCC(F)F)Cc1ccc(COc2ccc3c(CO)cc(=O)oc3c2)cc1

InChI Key InChIKey=HUXCCRUQLRWJNF-UHFFFAOYSA-N

Data  2 KI  3 IC50  1 Kd

  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 6 hits for monomerid = 50585934   

TargetAmine oxidase [flavin-containing] B(Human)
University of Bari "Aldo Moro

Curated by ChEMBL
LigandPNGBDBM50585934(CHEMBL5082824)
Affinity DataIC50: 8.20nMAssay Description:Inhibition of human recombinant MAO-B expressed in supersomes assessed as inhibition of 4-hydroxyquinoline formation using kynuramine as substrate by...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/7/2023
Entry Details Article
PubMed
TargetAcetylcholinesterase(Human)
University of Bari "Aldo Moro

Curated by ChEMBL
LigandPNGBDBM50585934(CHEMBL5082824)
Affinity DataIC50: 550nMAssay Description:Inhibition of human recombinant AChE by Ellman's spectrophotometric assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/7/2023
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
University of Bari "Aldo Moro

Curated by ChEMBL
LigandPNGBDBM50585934(CHEMBL5082824)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of human recombinant CYP3A4 expressed in baculosomes by fluorescent homogenous assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/7/2023
Entry Details Article
PubMed
TargetAlbumin(Human)
University of Bari "Aldo Moro

Curated by ChEMBL
LigandPNGBDBM50585934(CHEMBL5082824)
Affinity DataKd:  1.13E+4nMAssay Description:Binding affinity to human serum albumin assessed as dissociation rate constant by surface plasmon resonance assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/7/2023
Entry Details Article
PubMed
TargetAmine oxidase [flavin-containing] B(Human)
University of Bari "Aldo Moro

Curated by ChEMBL
LigandPNGBDBM50585934(CHEMBL5082824)
Affinity DataKi:  13nMAssay Description:Competitive inhibition of human recombinant MAO-B expressed in supersomes using kynuramine as substrate by Lineweaver-Burk plot analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/7/2023
Entry Details Article
PubMed
TargetAcetylcholinesterase(Human)
University of Bari "Aldo Moro

Curated by ChEMBL
LigandPNGBDBM50585934(CHEMBL5082824)
Affinity DataKi:  2.00E+3nMAssay Description:Mixed type inhibition of human AChE by Lineweaver-Burk plot analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/7/2023
Entry Details Article
PubMed