Reaction Details Report a problem with these data
Target
Melatonin receptor type 1B
Ligand
BDBM50419039
Substrate
n/a
Meas. Tech.
ChEMBL_762353 (CHEMBL1816424)
Ki
40.74±n/a nM
Citation
 Spadoni, G; Bedini, A; Orlando, P; Lucarini, S; Tarzia, G; Mor, M; Rivara, S; Lucini, V; Pannacci, M; Scaglione, F Bivalent ligand approach on N-{2-[(3-methoxyphenyl)methylamino]ethyl}acetamide: synthesis, binding affinity and intrinsic activity for MT(1) and MT(2) melatonin receptors. Bioorg Med Chem 19:4910-6 (2011) [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:
BDBM50419039
Synonyms:
CHEMBL1813323
Type:
Small organic molecule
Emp. Form.:
C32H50N4O4
Mol. Mass.:
554.7638
SMILES:
CN(CCNC(C)=O)c1cccc(OCCCCCCCCCCOc2cccc(c2)N(C)CCNC(C)=O)c1
Structure:
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