Reaction Details  Report a problem with these data
Target
Melatonin receptor type 1B
Ligand
BDBM50551218
Substrate
n/a
Meas. Tech.
ChEMBL_2030741 (CHEMBL4684899)
EC50
428±n/a nM
Citation
 Bolteau, R; Descamps, F; Ettaoussi, M; Caignard, DH; Delagrange, P; Melnyk, P; Yous, S Quinazoline and phthalazine derivatives as novel melatonin receptor ligands analogues of agomelatine. Eur J Med Chem 189:0 (2020) [PubMed]  Article
Target
Name:
Melatonin receptor type 1B
Synonyms:
MTNR1B | MTR1B_HUMAN | Mel-1B-R | Mel1b melatonin receptor | Melatonin 1B | Melatonin receptor | Melatonin receptor type 1B | Melatonin receptor type 2 (MT2)
Type:
Enzyme
Mol. Mass.:
40203.54
Organism:
Homo sapiens (Human)
Description:
P49286
Residue:
362
Sequence:
MSENGSFANCCEAGGWAVRPGWSGAGSARPSRTPRPPWVAPALSAVLIVTTAVDVVGNLLVILSVLRNRKLRNAGNLFLVSLALADLVVAFYPYPLILVAIFYDGWALGEEHCKASAFVMGLSVIGSVFNITAIAINRYCYICHSMAYHRIYRRWHTPLHICLIWLLTVVALLPNFFVGSLEYDPRIYSCTFIQTASTQYTAAVVVIHFLLPIAVVSFCYLRIWVLVLQARRKAKPESRLCLKPSDLRSFLTMFVVFVIFAICWAPLNCIGLAVAINPQEMAPQIPEGLFVTSYLLAYFNSCLNAIVYGLLNQNFRREYKRILLALWNPRHCIQDASKGSHAEGLQSPAPPIIGVQHQADAL
  
Inhibitor
Name:
BDBM50551218
Synonyms:
CHEMBL4759137
Type:
Small organic molecule
Emp. Form.:
C13H15N3O2
Mol. Mass.:
245.2771
SMILES:
COc1ccc2cnnc(CCNC(C)=O)c2c1
Structure:
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