Synthesis and evaluation of diphenyl phosphonate esters as inhibitors of the trypsin-like granzymes A and K and mast cell tryptase

J Med Chem. 1998 Jun 18;41(13):2289-301. doi: 10.1021/jm970543s.

Abstract

Thirty-six new amino acid and peptidyl diphenyl phosphonate esters were synthesized and evaluated to identify potent and selective inhibitors for four trypsin-like proteases: lymphocyte granzymes A and K, human mast cell tryptase, and pancreatic trypsin. Among five Cbz derivatives of Lys and Arg homologues, Z-(4-AmPhe)P(OPh)2 is the most potent inhibitor for granzyme A, and Z-LysP(OPh)2 is the best inhibitor for granzyme K, mast tryptase, and trypsin. The amidino P1 residue D,L-(4-AmPhGly)P(OPh)2 was utilized in a series of compounds with several different N-protecting groups and systematic substitutions at P2 in Cbz-AA derivatives and at P3 in Cbz-AA-Ala derivatives. Generally, these phosphonates inhibit granzyme A and trypsin more potently than granzyme K and tryptase. The P2 Thr and Ala dipeptide phosphonates, Cbz-AA-(4-AmPhGly)P(OPh)2, are the most potent inhibitors for granzyme A, and Cbz-Thr-(4-AmPhGly)P(OPh)2 (kobs/[I] = 2220 M-1 s-1) was quite specific with much lower inhibition rates for granzyme K and trypsin (kobs/[I] = 3 and 97 M-1 s-1, respectively) and no inhibition with tryptase. The most effective inhibitor of granzyme A was Ph-SO2-Gly-Pro-(4-AmPhGly)P(OPh)2 with a second-order rate constant of 3650 M-1 s-1. The most potent inhibitor for granzyme K was 3, 3-diphenylpropanoyl-Pro-(4-AmPhGly)P(OPh)2 with a kobs/[I] = 1830 M-1 s-1; all other phosphonates inhibited granzyme K weakly (kobs/[I] < 60 M-1 s-1). Human mast cell tryptase was inhibited slowly by these phosphonates with Cbz-LysP(OPh)2 as the best inhibitor (kobs/[I] = 89 M-1 s-1). The overall results suggest that scaffolds of Phe-Thr-(4-AmPhe) and Phe-Pro-Lys will be useful to create selective phosphonate inhibitors for granzymes A and K, respectively, and that P4 substituents offer opportunities to further enhance selectivity and reactivity.

Publication types

  • Comparative Study
  • Research Support, Non-U.S. Gov't
  • Research Support, U.S. Gov't, P.H.S.

MeSH terms

  • Amino Acids* / chemical synthesis
  • Amino Acids* / chemistry
  • Amino Acids* / pharmacology
  • Animals
  • Cattle
  • Chymases
  • Granzymes
  • Humans
  • Kinetics
  • Mast Cells / enzymology
  • Oligopeptides* / chemical synthesis
  • Oligopeptides* / chemistry
  • Oligopeptides* / pharmacology
  • Organophosphonates* / chemical synthesis
  • Organophosphonates* / chemistry
  • Organophosphonates* / pharmacology
  • Rats
  • Serine Endopeptidases / metabolism*
  • Serine Proteinase Inhibitors* / chemical synthesis
  • Serine Proteinase Inhibitors* / chemistry
  • Serine Proteinase Inhibitors* / pharmacology
  • Structure-Activity Relationship
  • T-Lymphocytes, Cytotoxic / enzymology
  • Trypsin / metabolism
  • Trypsin Inhibitors / chemical synthesis
  • Trypsin Inhibitors / chemistry
  • Trypsin Inhibitors / pharmacology
  • Tryptases

Substances

  • Amino Acids
  • Oligopeptides
  • Organophosphonates
  • Serine Proteinase Inhibitors
  • Trypsin Inhibitors
  • Granzymes
  • Serine Endopeptidases
  • chymase 2
  • Chymases
  • Trypsin
  • Tpsab1 protein, rat
  • Tpsb2 protein, rat
  • Tryptases
  • GZMA protein, human