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Name | Melatonin receptor type 1B |
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Species | Homo sapiens (Human) |
Gene | MTNR1B |
Synonym | MT2 receptor mel1b receptor Mel-1B-R |
Disease | Epilepsy |
Length | 362 |
Amino acid sequence | MSENGSFANCCEAGGWAVRPGWSGAGSARPSRTPRPPWVAPALSAVLIVTTAVDVVGNLLVILSVLRNRKLRNAGNLFLVSLALADLVVAFYPYPLILVAIFYDGWALGEEHCKASAFVMGLSVIGSVFNITAIAINRYCYICHSMAYHRIYRRWHTPLHICLIWLLTVVALLPNFFVGSLEYDPRIYSCTFIQTASTQYTAAVVVIHFLLPIAVVSFCYLRIWVLVLQARRKAKPESRLCLKPSDLRSFLTMFVVFVIFAICWAPLNCIGLAVAINPQEMAPQIPEGLFVTSYLLAYFNSCLNAIVYGLLNQNFRREYKRILLALWNPRHCIQDASKGSHAEGLQSPAPPIIGVQHQADAL |
UniProt | P49286 |
Protein Data Bank | N/A |
GPCR-HGmod model | P49286 |
3D structure model | This predicted structure model is from GPCR-EXP P49286. |
BioLiP | N/A |
Therapeutic Target Database | T48268 |
ChEMBL | CHEMBL1946 |
IUPHAR | 288 |
DrugBank | BE0000327 |
Name | CHEMBL10328 |
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Molecular formula | C21H22N2O |
IUPAC name | N-[2-(6H-isoindolo[2,1-a]indol-11-yl)ethyl]butanamide |
Molecular weight | 318.42 |
Hydrogen bond acceptor | 1 |
Hydrogen bond donor | 1 |
XlogP | 3.7 |
Synonyms | N-[2-(6H-Isoindolo[2,1-a]indole-11-yl)ethyl]butanamide BDBM50086010 N-[2-(6H-Isoindolo[2,1-a]indol-11-yl)-ethyl]-butyramide |
Inchi Key | BQCYDDRANOAMHI-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C21H22N2O/c1-2-7-20(24)22-13-12-18-17-10-5-6-11-19(17)23-14-15-8-3-4-9-16(15)21(18)23/h3-6,8-11H,2,7,12-14H2,1H3,(H,22,24) |
PubChem CID | 10591657 |
ChEMBL | CHEMBL10328 |
IUPHAR | N/A |
BindingDB | 50086010 |
DrugBank | N/A |
Structure | ![]() |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
Ki | 12.0 nM | PMID10737738 | BindingDB,ChEMBL |
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