Drug General Information
Drug ID
DX4R1K
Drug Name
N-tert-Butyl-2-((3R,5R)-8-methyl-2-oxo-5-phenyl-3-{3-[3-(toluene-2-sulfonylaminocarbonyl)-phenyl]-ureido}-2,3,4,5-tetrahydro-benzo[b]azepin-1-yl)-acetamide
Synonyms
CHEMBL58154
Indication Discovery agent Investigative [1587926]
Formula
C38H41N5O6S
Canonical SMILES
Cc1ccc2[C@H](C[C@@H](NC(=O)Nc3cccc(c3)C(=O)NS(=O)(=O)c4ccccc4C)C(=O)N(CC(=O)NC(C)(C)C)c2c1)c5ccccc5
InChI
InChI=1S/C38H41N5O6S/c1-24-18-19-29-30(26-13-7-6-8-14-26)22-31(36(46)43(32(29)20-24)23-34(44)41-38(3,4)5)40-37(47)39-28-16-11-15-27(21-28)35(45)42-50(48,49)33-17-10-9-12-25(33)2/h6-21,30-31H,22-23H2,1-5H3,(H,41,44)(H,42,45)(H2,39,40,47)/t30-,31-/m1/s1
InChIKey
CSNNJXSLJWKSCD-FIRIVFDPSA-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

If You Find Any Error in Data or Bug in Web Service, Please Kindly Report It to Dr. Zhou and Dr. Zhang.