Drug General Information
Drug ID
DXE8YD
Drug Name
N-tert-Butyl-2-[(3R,5S,7R)-2-oxo-5-phenyl-7-m-tolyl-3-(3-m-tolyl-ureido)-azepan-1-yl]-acetamide
Synonyms
CHEMBL316504
Indication Discovery agent Investigative [1587926]
Formula
C33H40N4O3
Canonical SMILES
Cc1cccc(NC(=O)N[C@@H]2C[C@@H](C[C@@H](N(CC(=O)NC(C)(C)C)C2=O)c3cccc(C)c3)c4ccccc4)c1
InChI
InChI=1S/C33H40N4O3/c1-22-11-9-15-25(17-22)29-20-26(24-13-7-6-8-14-24)19-28(31(39)37(29)21-30(38)36-33(3,4)5)35-32(40)34-27-16-10-12-23(2)18-27/h6-18,26,28-29H,19-21H2,1-5H3,(H,36,38)(H2,34,35,40)/t26-,28+,29+/m0/s1
InChIKey
DXRCYRRBLUBBSH-WIIGKZCBSA-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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