Drug Information

Drug General Information
Drug ID
D0JE3Z
Former ID
DNC009014
Drug Name
4-fluorobenzoyl-Phe-Gly-Leu-Arg-Trp-NH2
Drug Type
Small molecular drug
Indication Discovery agent Investigative [529804]
Structure
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2D MOL

3D MOL
Formula
C41H51FN10O6
Canonical SMILES
CC(C)CC(C(=O)NC(CCCN=C(N)N)C(=O)NC(CC1=CNC2=CC=CC=C21)C<br />(=O)N)NC(=O)CNC(=O)C(CC3=CC=CC=C3)NC(=O)C4=CC=C(C=C4)F
InChI
1S/C41H51FN10O6/c1-24(2)19-33(49-35(53)23-48-38(56)34(20-25-9-4-3-5-10-25)52-37(55)26-14-16-28(42)17-15-26)40(58)50-31(13-8-18-46-41(44)45)39(57)51-32(36(43)54)21-27-22-47-30-12-7-6-11-29(27)30/h3-7,9-12,14-17,22,24,31-34,47H,8,13,18-21,23H2,1-2H3,(H2,43,54)(H,48,56)(H,49,53)(H,50,58)(H,51,57)(H,52,55)(H4,44,45,46)/t31-,32-,33-,34-/m0/s1
InChIKey
CSDUUNOZBMGMHZ-CUPIEXAXSA-N
PubChem Compound ID
16735569
Target and Pathway
Target(s) G-protein coupled receptor 54 Target Info Inhibitor [529804]
KEGG Pathway Neuroactive ligand-receptor interaction
Reactome Peptide ligand-binding receptors
G alpha (q) signalling events
WikiPathways Gastrin-CREB signalling pathway via PKC and MAPK
GPCR ligand binding
GPCR downstream signaling
References
Ref 529804J Med Chem. 2008 Dec 11;51(23):7645-9.Development of novel G-protein-coupled receptor 54 agonists with resistance to degradation by matrix metalloproteinase.
Ref 529804J Med Chem. 2008 Dec 11;51(23):7645-9.Development of novel G-protein-coupled receptor 54 agonists with resistance to degradation by matrix metalloproteinase.

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