Drug General Information
Drug ID
DXQJ9C
Drug Name
N-tert-Butyl-2-[(3R,5S,7R)-2-oxo-5,7-diphenyl-3-(3-m-tolyl-ureido)-azepan-1-yl]-acetamide
Synonyms
CHEMBL327526
Indication Discovery agent Investigative [1587926]
Formula
C32H38N4O3
Canonical SMILES
Cc1cccc(NC(=O)N[C@@H]2C[C@@H](C[C@@H](N(CC(=O)NC(C)(C)C)C2=O)c3ccccc3)c4ccccc4)c1
InChI
InChI=1S/C32H38N4O3/c1-22-12-11-17-26(18-22)33-31(39)34-27-19-25(23-13-7-5-8-14-23)20-28(24-15-9-6-10-16-24)36(30(27)38)21-29(37)35-32(2,3)4/h5-18,25,27-28H,19-21H2,1-4H3,(H,35,37)(H2,33,34,39)/t25-,27+,28+/m0/s1
InChIKey
NAYWENBSENWRRT-KJYTXNCISA-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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