Design, synthesis, and biological activity of novel polycyclic aza-amide FKBP12 ligands

J Med Chem. 2006 Feb 9;49(3):1202-6. doi: 10.1021/jm049161u.

Abstract

Since the discovery that FK-506 promotes neurite outgrowth, considerable attention has been focused on the development of potent nonimmunosuppressive ligands for FK-506 binding proteins (FKBPs). Such neuroimmunophilin agents have been reported to show neuroregenerative activity in a variety of cell and animal models including neurite outgrowth, age-related cognitive decline, Parkinson's disease, peripheral nerve injury, optic nerve degeneration, and diabetic neuropathy. We have designed and synthesized a unique series of tetracyclic aza-amides that have been shown to be potent FKBP12 rotamase inhibitors. The structure-activity relationships established in this study have demonstrated diverse structural modifications that result in potent rotamase inhibitory activity.

MeSH terms

  • Amides / chemical synthesis*
  • Amides / chemistry
  • Aza Compounds / chemical synthesis*
  • Aza Compounds / chemistry
  • Binding Sites
  • Heterocyclic Compounds, 4 or More Rings / chemical synthesis*
  • Heterocyclic Compounds, 4 or More Rings / chemistry
  • Hydrogen Bonding
  • Isoquinolines / chemical synthesis
  • Isoquinolines / chemistry
  • Ligands
  • Neuroprotective Agents / chemical synthesis*
  • Neuroprotective Agents / chemistry
  • Structure-Activity Relationship
  • Tacrolimus / chemistry
  • Tacrolimus Binding Protein 1A / antagonists & inhibitors*
  • Tacrolimus Binding Protein 1A / chemistry*

Substances

  • Amides
  • Aza Compounds
  • Heterocyclic Compounds, 4 or More Rings
  • Isoquinolines
  • Ligands
  • Neuroprotective Agents
  • Tacrolimus Binding Protein 1A
  • Tacrolimus