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Compile Data Set for Download or QSAR
Found
1
Enz. Inhib. hit(s) with Target = 'Melatonin receptor type 1A' and Ligand = 'BDBM103436'
Target
Melatonin receptor type 1A
(Homo sapiens (Human))
Takeda Pharmaceutical Co., Ltd
US Patent
Ligand
BDBM103436
(US8552037, 81)
Show SMILES
CC(=O)NCC=C1CCc2ccc3nc(C)oc3c12
Show InChI
InChI=1S/C15H16N2O2/c1-9(18)16-8-7-12-4-3-11-5-6-13-15(14(11)12)19-10(2)17-13/h5-7H,3-4,8H2,1-2H3,(H,16,18)
Affinity Data
IC50: 0.330nM
Assay Description:
Binding assay using melatonin receptors 1 or 2.
More data for this Ligand-Target Pair
Target Info
PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
Ligand Info
PC cid
PC sid
Similars
In Depth
Details
BDB Entry
US Patent