BDBM50637174 CHEMBL5568537

SMILES COc1cc(Br)c(Cc2cc(OC)c(OC)cc2CC(=O)OC(C)(C)C)cc1OC

InChI Key InChIKey=BWWDVYDIORRFFV-UHFFFAOYSA-N

Data  2 KI

  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 = 50637174   

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

Curated by ChEMBL
LigandPNGBDBM50637174(CHEMBL5568537)
Affinity DataKi:  1.40nMMore data for this Ligand-Target Pair
Ligand Info
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
LigandPNGBDBM50637174(CHEMBL5568537)
Affinity DataKi:  1.20E+3nMMore data for this Ligand-Target Pair
Ligand Info
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed