BDBM50564115 CHEMBL4794879

SMILES CNc1nnc(CCc2c[nH]c3ccc(OC)cc23)o1

InChI Key InChIKey=BQFCFEKFFSVPDO-UHFFFAOYSA-N

Data  2 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 5 hits for monomerid = 50564115   

TargetMelatonin receptor type 1B(Human)
IQM-CSIC

Curated by ChEMBL
LigandPNGBDBM50564115(CHEMBL4794879)
Affinity DataKi:  110nMAssay Description:Displacement of [125l]-lodomelatonin from human MT2 receptor expressed in CHO cells incubated for 120 mins by scintillation counting analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/29/2022
Entry Details Article
PubMed
TargetMelatonin receptor type 1A(Human)
IQM-CSIC

Curated by ChEMBL
LigandPNGBDBM50564115(CHEMBL4794879)
Affinity DataKi:  550nMAssay Description:Displacement of [125l]-lodomelatonin from human MT1 receptor expressed in CHO cells incubated for 120 mins by scintillation counting analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/29/2022
Entry Details Article
PubMed
TargetAmine oxidase [flavin-containing] B(Human)
IQM-CSIC

Curated by ChEMBL
LigandPNGBDBM50564115(CHEMBL4794879)
Affinity DataIC50: 3.70E+4nMAssay Description:Inhibition of human MAO-B using p-tyramine as substrate by Amplex Red reagent based fluorescence analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/29/2022
Entry Details Article
PubMed
TargetAmine oxidase [flavin-containing] A(Human)
IQM-CSIC

Curated by ChEMBL
LigandPNGBDBM50564115(CHEMBL4794879)
Affinity DataIC50: 5.00E+4nMAssay Description:Inhibition of human MAO-A using p-tyramine as substrate by Amplex Red reagent based fluorescence analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/29/2022
Entry Details Article
PubMed
TargetPolyunsaturated fatty acid 5-lipoxygenase(Human)
IQM-CSIC

Curated by ChEMBL
LigandPNGBDBM50564115(CHEMBL4794879)
Affinity DataIC50: 6.06E+4nMAssay Description:Inhibition of human 5-Lipoxygenase using H2DCFDA as substrate preincubated for 5 mins and measured by Spectrophotometric assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/29/2022
Entry Details Article
PubMed