Drug General Information
Drug ID
DXY3IY
Drug Name
[(S)-1-[(S)-1-(4-Benzoyl-piperidine-1-carbonyl)-3-methyl-butylcarbamoyl]-2-(1H-indol-3-yl)-ethyl]-carbamic acid tert-butyl ester
Synonyms
CHEMBL320886
Indication Discovery agent Investigative [1587926]
Formula
C34H44N4O5
Canonical SMILES
CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N3CCC(CC3)C(=O)c4ccccc4
InChI
InChI=1S/C34H44N4O5/c1-22(2)19-29(32(41)38-17-15-24(16-18-38)30(39)23-11-7-6-8-12-23)36-31(40)28(37-33(42)43-34(3,4)5)20-25-21-35-27-14-10-9-13-26(25)27/h6-14,21-22,24,28-29,35H,15-20H2,1-5H3,(H,36,40)(H,37,42)/t28-,29-/m0/s1
InChIKey
ZOZPVKJSFYNWLP-VMPREFPWSA-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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