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Name | Melatonin receptor type 1B |
---|---|
Species | Gallus gallus (Chicken) |
Gene | |
Synonym | Mel-1B-R Mel1b receptor |
Disease | N/A for non-human GPCRs |
Length | 289 |
Amino acid sequence | GNAFVVSLALADLVVALYPYPLVLLAIFHNGWTLGEMHCKVSGFVMGLSVIGSIFNITAIAINRYCYICHSFAYDKVYSCWNTMLYVSLIWVLTVIATVPNFFVGSLKYDPRIYSCTFVQTASSYYTIAVVVIHFIVPITVVSFCYLRIWVLVLQVRRRVKSETKPRLKPSDFRNFLTMFVVFVIFAFCWAPLNFIGLAVAINPSEMAPKVPEWLFIISYFMAYFNSCLNAIIYGLLNQNFRNEYKRILMSLWMPRLFFQDTSKGGTDGQKSKPSPALNNNDQMKTDTL |
UniProt | P51050 |
Protein Data Bank | N/A |
GPCR-HGmod model | N/A |
3D structure model | No available structures or models |
BioLiP | N/A |
Therapeutic Target Database | N/A |
ChEMBL | CHEMBL4466 |
IUPHAR | N/A |
DrugBank | N/A |
Name | CHEMBL112164 |
---|---|
Molecular formula | C14H19NO2 |
IUPAC name | N-[(4-methoxy-7-bicyclo[4.2.0]octa-1(6),2,4-trienyl)methyl]butanamide |
Molecular weight | 233.311 |
Hydrogen bond acceptor | 2 |
Hydrogen bond donor | 1 |
XlogP | 1.4 |
Synonyms | BDBM50072655 N-(4-Methoxy-bicyclo[4.2.0]octa-1,3,5-trien-7-ylmethyl)-butyramide |
Inchi Key | QWJALEIUJNONIK-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C14H19NO2/c1-3-4-14(16)15-9-11-7-10-5-6-12(17-2)8-13(10)11/h5-6,8,11H,3-4,7,9H2,1-2H3,(H,15,16) |
PubChem CID | 44340855 |
ChEMBL | CHEMBL112164 |
IUPHAR | N/A |
BindingDB | 50072655 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
Ki | 49.0 nM | PMID9873728 | BindingDB,ChEMBL |
zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417