Drug Information
Drug General Information | Top | |||
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Drug ID |
D0Q6HT
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Former ID |
DNC006639
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Drug Name |
Beta,beta-dimethylmelatonin
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Synonyms |
CHEMBL206472; beta,beta-dimethylmelatonin; BDBM50188423
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Drug Type |
Small molecular drug
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Indication | Discovery agent [ICD-11: N.A.] | Investigative | [1] | |
Structure |
Download2D MOL |
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Formula |
C15H20N2O2
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Canonical SMILES |
CC(=O)NCC(C)(C)C1=CNC2=C1C=C(C=C2)OC
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InChI |
1S/C15H20N2O2/c1-10(18)17-9-15(2,3)13-8-16-14-6-5-11(19-4)7-12(13)14/h5-8,16H,9H2,1-4H3,(H,17,18)
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InChIKey |
OMYMGFDKAPBSGB-UHFFFAOYSA-N
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PubChem Compound ID |
Target and Pathway | Top | |||
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Target(s) | Melatonin receptor type 1A (MTNR1A) | Target Info | Inhibitor | [1] |
Melatonin receptor type 1B (MTNR1B) | Target Info | Inhibitor | [1] | |
KEGG Pathway | Neuroactive ligand-receptor interaction | |||
Circadian entrainment | ||||
Reactome | Class A/1 (Rhodopsin-like receptors) | |||
G alpha (i) signalling events | ||||
WikiPathways | GPCRs, Class A Rhodopsin-like | |||
Small Ligand GPCRs | ||||
GPCR ligand binding | ||||
GPCR downstream signaling |
References | Top | |||
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REF 1 | Mapping the melatonin receptor. 7. Subtype selective ligands based on beta-substituted N-acyl-5-methoxytryptamines and beta-substituted N-acyl-5-me... J Med Chem. 2006 Jun 15;49(12):3509-19. |
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