Improving metabolic stability with deuterium: The discovery of HWL-066, a potent and long-acting free fatty acid receptor 1 agonists

Chem Biol Drug Des. 2018 Aug;92(2):1547-1554. doi: 10.1111/cbdd.13321. Epub 2018 May 18.

Abstract

The free fatty acid receptor 1 (FFA1) is a potential target due to its function in enhancing of glucose-stimulated insulin secretion. The FFA1 agonist GW9508 has great potential for the treatment of type 2 diabetes mellitus, but it has been suffering from high plasma clearance probably because the phenylpropanoic acid is vulnerable to β-oxidation. To identify orally available analog without influence on the unique pharmacological mechanism of GW9508, we tried to interdict the metabolically labile group by incorporating two deuterium atoms at the α-position of phenylpropionic acid affording compound 4 (HWL-066). As expected, HWL-066 revealed a lower clearance (CL = 0.23 L-1 hr-1 kg-1 ), higher maximum concentration (Cmax = 5907.47 μg/L), and longer half-life (T1/2 = 3.50 hr), resulting in a 2.8-fold higher exposure than GW9508. Moreover, the glucose-lowering effect of HWL-066 was far better than that of GW9508 and comparable with TAK-875. Different from glibenclamide, no side-effect of hypoglycemia was observed in mice after oral administrating HWL-066 (80 mg/kg).

Keywords: deuterium; diabetes; free fatty acid receptor; pharmacokinetic profiles; phenylpropanoic acid.

Publication types

  • Research Support, Non-U.S. Gov't

MeSH terms

  • Animals
  • Binding Sites
  • Calcium / metabolism
  • Deuterium / chemistry
  • Deuterium / metabolism
  • Glucose Tolerance Test
  • Half-Life
  • Humans
  • Hydrogen Bonding
  • Hypoglycemia / drug therapy
  • Hypoglycemic Agents / chemistry*
  • Hypoglycemic Agents / metabolism
  • Hypoglycemic Agents / therapeutic use
  • Male
  • Methylamines / pharmacokinetics
  • Methylamines / pharmacology
  • Mice
  • Mice, Inbred ICR
  • Molecular Docking Simulation
  • Propionates / chemistry*
  • Propionates / metabolism
  • Propionates / pharmacokinetics
  • Propionates / pharmacology
  • Propionates / therapeutic use
  • Rats
  • Rats, Sprague-Dawley
  • Receptors, G-Protein-Coupled / agonists*
  • Receptors, G-Protein-Coupled / genetics
  • Receptors, G-Protein-Coupled / metabolism

Substances

  • FFAR1 protein, human
  • GW9508
  • Hypoglycemic Agents
  • Methylamines
  • Propionates
  • Receptors, G-Protein-Coupled
  • Deuterium
  • Calcium