Drug Information

Drug General Information
Drug ID
D0H2UT
Former ID
DIB019029
Drug Name
brucine
Synonyms
10,11-dimethoxy strychnine
Drug Type
Small molecular drug
Indication Discovery agent Investigative [540364]
Structure
Download
2D MOL
Formula
C23H26N2O4
InChI
InChI=1S/C23H26N2O4/c1-27-16-8-14-15(9-17(16)28-2)25-20(26)10-18-21-13-7-19-23(14,22(21)25)4-5-24(19)11-12(13)3-6-29-18/h3,8-9,13,18-19,21-22H,4-7,10-11H2,1-2H3/t13-,18-,19-,21-,22-,23+/m0/s1
InChIKey
RRKTZKIUPZVBMF-IBTVXLQLSA-N
PubChem Compound ID
442021
PubChem Substance ID
11276, 598388, 840738, 10298947, 14719301, 14903268, 24864782, 26746579, 36885681, 46386939, 47657001, 47880005, 49681539, 57403888, 76762786, 85842983, 87563676, 87563907, 92308664, 93622920, 103654800, 104626693, 118964464, 119501368, 124659063, 124812305, 126609088, 129171059, 134973275, 135652672, 136368363, 136904068, 137171662, 144101886, 144204902, 144212491, 152095097, 152164256, 152248216, 162091246, 162180531, 163123724, 163350061, 163614688, 172080451, 179230492, 198939562, 204378260, 223439149, 223534016
Target and Pathway
Target(s) Muscarinic acetylcholine receptor M3 Target Info Modulator (allosteric modulator) [534573]
Muscarinic receptor Target Info Modulator (allosteric modulator) [534573]
KEGG Pathway Calcium signaling pathway
Neuroactive ligand-receptor interaction
Cholinergic synapse
Regulation of actin cytoskeleton
Insulin secretion
Salivary secretion
Gastric acid secretion
Pancreatic secretionhsa04020:Calcium signaling pathway
cAMP signaling pathway
PI3K-Akt signaling pathway
PANTHER Pathway Alzheimer disease-amyloid secretase pathway
Heterotrimeric G-protein signaling pathway-Gq alpha and Go alpha mediated pathway
Muscarinic acetylcholine receptor 1 and 3 signaling pathway
PathWhiz Pathway Gastric Acid ProductionPW000564:Muscle/Heart Contraction
Reactome Muscarinic acetylcholine receptors
Acetylcholine regulates insulin secretion
G alpha (q) signalling eventsR-HSA-390648:Muscarinic acetylcholine receptors
G alpha (q) signalling events
WikiPathways Monoamine GPCRs
Calcium Regulation in the Cardiac Cell
Regulation of Actin Cytoskeleton
GPCRs, Class A Rhodopsin-like
Gastrin-CREB signalling pathway via PKC and MAPK
Integration of energy metabolism
GPCR ligand binding
GPCR downstream signaling
GPCRs, OtherWP58:Monoamine GPCRs
Secretion of Hydrochloric Acid in Parietal Cells
References
Ref 540364(http://www.guidetopharmacology.org/) Nucleic Acids Res. 2015 Oct 12. pii: gkv1037. The IUPHAR/BPS Guide to PHARMACOLOGY in 2016: towards curated quantitative interactions between 1300 protein targets and 6000 ligands. (Ligand id: 342).
Ref 534573Subtype-selective positive cooperative interactions between brucine analogues and acetylcholine at muscarinic receptors: radioligand binding studies. Mol Pharmacol. 1998 Mar;53(3):573-89.

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