Drug General Information
Drug ID
DXB9WE
Drug Name
{[2-(Adamantan-2-yloxycarbonylamino)-3-(4-bromo-phenyl)-2-methyl-propionyl]-phenethyl-amino}-acetic acid
Synonyms
CHEMBL320399
Indication Discovery agent Investigative [1587926]
Formula
C31H37BrN2O5
Canonical SMILES
CC(Cc1ccc(Br)cc1)(NC(=O)OC2[C@@H]3C[C@H]4C[C@H](C[C@@H]2C4)C3)C(=O)N(CCc5ccccc5)CC(=O)O
InChI
InChI=1S/C31H37BrN2O5/c1-31(18-21-7-9-26(32)10-8-21,29(37)34(19-27(35)36)12-11-20-5-3-2-4-6-20)33-30(38)39-28-24-14-22-13-23(16-24)17-25(28)15-22/h2-10,22-25,28H,11-19H2,1H3,(H,33,38)(H,35,36)/t22-,23+,24-,25+,28?,31?
InChIKey
HMGDEYJMBGQTPV-ACIJABRLSA-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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