Drug General Information
Drug ID
DX1ASX
Drug Name
(S)-N-((S)-1-Carbamoyl-2-phenyl-ethyl)-3-[(S)-2-((S)-3-1H-indol-3-yl-2-phenylacetylamino-propionylamino)-6-(3-o-tolyl-ureido)-hexanoylamino]-N-methyl-succinamic acid
Synonyms
CHEMBL322391
Indication Discovery agent Investigative [1587926]
Formula
C47H54N8O8
Canonical SMILES
CN([C@@H](Cc1ccccc1)C(=O)N)C(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCNC(=O)Nc2ccccc2C)NC(=O)[C@H](Cc3c[nH]c4ccccc34)NC(=O)Cc5ccccc5
InChI
InChI=1S/C47H54N8O8/c1-30-15-9-11-21-35(30)54-47(63)49-24-14-13-23-37(44(60)53-39(28-42(57)58)46(62)55(2)40(43(48)59)25-31-16-5-3-6-17-31)52-45(61)38(51-41(56)26-32-18-7-4-8-19-32)27-33-29-50-36-22-12-10-20-34(33)36/h3-12,15-22,29,37-40,50H,13-14,23-28H2,1-2H3,(H2,48,59)(H,51,56)(H,52,61)(H,53,60)(H,57,58)(H2,49,54,63)/t37-,38-,39-,40-/m0/s1
InChIKey
GJPJKRUMWUUTLI-YKKXUYLKSA-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.