Drug General Information
Drug ID
DX6UM8
Drug Name
N-tert-Butyl-2-[(3R,5S,7R)-5-(2-ethyl-phenyl)-2-oxo-7-phenyl-3-(3-m-tolyl-ureido)-azepan-1-yl]-acetamide
Synonyms
CHEMBL97133
Indication Discovery agent Investigative [1587926]
Formula
C34H42N4O3
Canonical SMILES
CCc1ccccc1[C@H]2C[C@@H](NC(=O)Nc3cccc(C)c3)C(=O)N(CC(=O)NC(C)(C)C)[C@H](C2)c4ccccc4
InChI
InChI=1S/C34H42N4O3/c1-6-24-14-10-11-18-28(24)26-20-29(36-33(41)35-27-17-12-13-23(2)19-27)32(40)38(22-31(39)37-34(3,4)5)30(21-26)25-15-8-7-9-16-25/h7-19,26,29-30H,6,20-22H2,1-5H3,(H,37,39)(H2,35,36,41)/t26-,29+,30+/m0/s1
InChIKey
AKHKIVGBTDKSGG-NPBSGPTKSA-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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