BDBM50637170 CHEMBL5558348

SMILES COc1ccc2c(c1)c(C(C)(C)CNC(C)=O)c1n2CCc2ccccc2-1

InChI Key

  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 2 hits for monomerid = 50637170   

TargetMelatonin receptor type 1B(Human)
The First Affiliated Hospital of China Medical University

Curated by ChEMBL
LigandPNGBDBM50637170(CHEMBL5558348)
Affinity DataKi:  0.5nMAssay Description:Binding affinity to human MT2 receptor assessed as inhibition constantMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed
TargetMelatonin receptor type 1A(Human)
The First Affiliated Hospital of China Medical University

Curated by ChEMBL
LigandPNGBDBM50637170(CHEMBL5558348)
Affinity DataKi:  55nMAssay Description:Binding affinity to human MT1 receptor assessed as inhibition constantMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed