Drug General Information
Drug ID
DXM1MH
Drug Name
N-tert-Butyl-2-{(3R,5R)-3-[3-(3-chloro-phenyl)-ureido]-8-methyl-2-oxo-5-p-tolyl-2,3,4,5-tetrahydro-benzo[b]azepin-1-yl}-acetamide
Synonyms
CHEMBL339678
Indication Discovery agent Investigative [1587926]
Formula
C31H35ClN4O3
Canonical SMILES
Cc1ccc(cc1)[C@H]2C[C@@H](NC(=O)Nc3cccc(Cl)c3)C(=O)N(CC(=O)NC(C)(C)C)c4cc(C)ccc24
InChI
InChI=1S/C31H35ClN4O3/c1-19-9-12-21(13-10-19)25-17-26(34-30(39)33-23-8-6-7-22(32)16-23)29(38)36(18-28(37)35-31(3,4)5)27-15-20(2)11-14-24(25)27/h6-16,25-26H,17-18H2,1-5H3,(H,35,37)(H2,33,34,39)/t25-,26-/m1/s1
InChIKey
SJDGAPPCMGPKLY-CLJLJLNGSA-N
Target and Pathway
Target(s) Gastrin/cholecystokinin type B receptor Target Info [1587926]
Cholecystokinin receptor type A Target Info [1587926]
KEGG Pathway Calcium signaling pathway
Neuroactive ligand-receptor interaction
Gastric acid secretionhsa04020:Calcium signaling pathway
Insulin secretion
Pancreatic secretion
PANTHER Pathway CCKR signaling map ST
PathWhiz Pathway Gastric Acid Production
Reactome Peptide ligand-binding receptors
G alpha (q) signalling events
Gastrin-CREB signalling pathway via PKC and MAPKR-HSA-375276:Peptide ligand-binding receptors
WikiPathways GPCRs, Class A Rhodopsin-like
Gastrin-CREB signalling pathway via PKC and MAPK
Secretion of Hydrochloric Acid in Parietal Cells
Peptide GPCRs
GPCR ligand binding
GPCR downstream signaling
GPCRs, OtherWP455:GPCRs, Class A Rhodopsin-like
References
Ref 1587926URL: https://www.ebi.ac.uk/chembl/ The ChEMBL database in 2017
Ref 1587926URL: https://www.ebi.ac.uk/chembl/ The ChEMBL database in 2017

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