Drug General Information
Drug ID
DX5UTM
Drug Name
3-({1-[2-tert-Butoxycarbonylamino-3-(1H-indol-3-yl)-propionyl]-3-propyl-pyrrolidine-2-carbonyl}-amino)-N-(1-carbamoyl-2-phenyl-ethyl)-succinamic acid
Synonyms
CHEMBL3143186
Indication Discovery agent Investigative [1587926]
Formula
C37H48N6O8
Canonical SMILES
CCC[C@@H]1CCN([C@@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(=O)N)C(=O)[C@H](Cc3c[nH]c4ccccc34)NC(=O)OC(C)(C)C
InChI
InChI=1S/C37H48N6O8/c1-5-11-23-16-17-43(35(49)29(42-36(50)51-37(2,3)4)19-24-21-39-26-15-10-9-14-25(24)26)31(23)34(48)41-28(20-30(44)45)33(47)40-27(32(38)46)18-22-12-7-6-8-13-22/h6-10,12-15,21,23,27-29,31,39H,5,11,16-20H2,1-4H3,(H2,38,46)(H,40,47)(H,41,48)(H,42,50)(H,44,45)/t23-,27+,28+,29+,31+/m1/s1
InChIKey
ZMALSGOXKJVYAU-UKJMRWJMSA-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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