Reaction Details  Report a problem with these data
Target
Melatonin receptor type 1B
Ligand
BDBM50240442
Substrate
n/a
Meas. Tech.
ChEMBL_304060 (CHEMBL839735)
Ki
8.7±n/a nM
Citation
 Rivara, S; Lorenzi, S; Mor, M; Plazzi, PV; Spadoni, G; Bedini, A; Tarzia, G Analysis of structure-activity relationships for MT2 selective antagonists by melatonin MT1 and MT2 receptor models. J Med Chem 48:4049-60 (2005) [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:
BDBM50240442
Synonyms:
CHEMBL33185 | N-((1-(4-chlorobenzyl)-4-methoxy-1H-indol-2-yl)methyl)propionamide | N-[1-(4-Chloro-benzyl)-4-methoxy-1H-indol-2-ylmethyl]-propionamide
Type:
Small organic molecule
Emp. Form.:
C20H21ClN2O2
Mol. Mass.:
356.846
SMILES:
CCC(=O)NCc1cc2c(OC)cccc2n1Cc1ccc(Cl)cc1
Structure:
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