Andrei I Khlebnikov

Summary

Country: Russia

Publications

  1. pmc Synthesis of new bitopic tetra(pyrazolyl)-ligands with neopentane and O-xylene backbones
    Andrei S Potapov
    Department of Chemistry, Altai State Technical University, 46 Lenin Street, Barnaul 656038, Russia
    ScientificWorldJournal 2012:798271. 2012
  2. pmc Computational structure-activity relationship analysis of small-molecule agonists for human formyl peptide receptors
    Andrei I Khlebnikov
    Department of Chemistry, Altai State Technical University, Barnaul 656038, Russia
    Eur J Med Chem 45:5406-19. 2010
  3. pmc Structure-activity relationship analysis of N-benzoylpyrazoles for elastase inhibitory activity: a simplified approach using atom pair descriptors
    Andrei I Khlebnikov
    Department of Chemistry, Altai State Technical University, Barnaul 656038, Russia
    Bioorg Med Chem 16:2791-802. 2008
  4. pmc Computational structure-activity relationship analysis of non-peptide inducers of macrophage tumor necrosis factor-alpha production
    Andrei I Khlebnikov
    Department of Chemistry, Altai State Technical University, Barnaul 656038, Russia
    Bioorg Med Chem 16:9302-12. 2008
  5. pmc Molecular docking of 2-(benzimidazol-2-ylthio)-N-phenylacetamide-derived small-molecule agonists of human formyl peptide receptor 1
    Andrei I Khlebnikov
    Department of Chemistry, Altai State Technical University, Barnaul, Russia
    J Mol Model 18:2831-43. 2012
  6. pmc Synthesis and oxidation of some azole-containing thioethers
    Andrei S Potapov
    Department of Chemistry, Altai State Technical University, 46 Lenin Ave, 656038 Barnaul, Russia
    Beilstein J Org Chem 7:1526-32. 2011
  7. pmc Improved quantitative structure-activity relationship models to predict antioxidant activity of flavonoids in chemical, enzymatic, and cellular systems
    Andrei I Khlebnikov
    Department of Chemistry, Altai State Technical University, Barnaul 656038, Russia
    Bioorg Med Chem 15:1749-70. 2007
  8. ncbi request reprint Quantitative structure-activity relationships for small non-peptide antagonists of CXCR2: indirect 3D approach using the frontal polygon method
    Andrei I Khlebnikov
    Department of Chemistry, Altai State Technical University, Barnaul 656099, Russia
    Bioorg Med Chem 14:352-65. 2006
  9. ncbi request reprint High-throughput screening for small-molecule activators of neutrophils: identification of novel N-formyl peptide receptor agonists
    Igor A Schepetkin
    Department of Veterinary Molecular Biology, Montana State University, Bozeman, Montana 59717, USA
    Mol Pharmacol 71:1061-74. 2007
  10. ncbi request reprint N-benzoylpyrazoles are novel small-molecule inhibitors of human neutrophil elastase
    Igor A Schepetkin
    Department of Veterinary Molecular Biology, Montana State University, Bozeman, Montana 59717, USA
    J Med Chem 50:4928-38. 2007

Collaborators

  • Lars Brive
  • Claes Dahlgren
  • Igor A Schepetkin
  • Andrei S Potapov
  • Mark T Quinn
  • Tatiana V Petrenko
  • Vladimir D Ogorodnikov
  • Liliya N Kirpotina
  • Evgenia A Nudnova
  • Nina P Chernova

Detail Information

Publications11

  1. pmc Synthesis of new bitopic tetra(pyrazolyl)-ligands with neopentane and O-xylene backbones
    Andrei S Potapov
    Department of Chemistry, Altai State Technical University, 46 Lenin Street, Barnaul 656038, Russia
    ScientificWorldJournal 2012:798271. 2012
    ..Several new bitopic pyrazole-containing ligands were prepared from the corresponding pyrazoles and tetrahalogen or tetratosyloxy derivatives of o-xylene and neopentane in a superbasic medium (KOH-DMSO)...
  2. pmc Computational structure-activity relationship analysis of small-molecule agonists for human formyl peptide receptors
    Andrei I Khlebnikov
    Department of Chemistry, Altai State Technical University, Barnaul 656038, Russia
    Eur J Med Chem 45:5406-19. 2010
    ..Importantly, these SAR rules represent a relatively simple classification approach for virtual screening of FPR1/FPR2 agonists...
  3. pmc Structure-activity relationship analysis of N-benzoylpyrazoles for elastase inhibitory activity: a simplified approach using atom pair descriptors
    Andrei I Khlebnikov
    Department of Chemistry, Altai State Technical University, Barnaul 656038, Russia
    Bioorg Med Chem 16:2791-802. 2008
    ..This simplified SAR approach may be useful to qualitative SAR recognition problems in a variety of data sets...
  4. pmc Computational structure-activity relationship analysis of non-peptide inducers of macrophage tumor necrosis factor-alpha production
    Andrei I Khlebnikov
    Department of Chemistry, Altai State Technical University, Barnaul 656038, Russia
    Bioorg Med Chem 16:9302-12. 2008
    ..Thus, these rules represent a relatively simple classification approach for de novo design of small-molecule inducers of macrophage TNF-alpha production...
  5. pmc Molecular docking of 2-(benzimidazol-2-ylthio)-N-phenylacetamide-derived small-molecule agonists of human formyl peptide receptor 1
    Andrei I Khlebnikov
    Department of Chemistry, Altai State Technical University, Barnaul, Russia
    J Mol Model 18:2831-43. 2012
    ..The understanding of these molecular features will likely prove beneficial in future design of novel FPR1 agonists based on the benzimidazole scaffold...
  6. pmc Synthesis and oxidation of some azole-containing thioethers
    Andrei S Potapov
    Department of Chemistry, Altai State Technical University, 46 Lenin Ave, 656038 Barnaul, Russia
    Beilstein J Org Chem 7:1526-32. 2011
    ..Selenium dioxide-catalyzed oxidation of benzotriazole thioether by H(2)O(2), however, proceeds selectively and yields sulfoxide only...
  7. pmc Improved quantitative structure-activity relationship models to predict antioxidant activity of flavonoids in chemical, enzymatic, and cellular systems
    Andrei I Khlebnikov
    Department of Chemistry, Altai State Technical University, Barnaul 656038, Russia
    Bioorg Med Chem 15:1749-70. 2007
    ....
  8. ncbi request reprint Quantitative structure-activity relationships for small non-peptide antagonists of CXCR2: indirect 3D approach using the frontal polygon method
    Andrei I Khlebnikov
    Department of Chemistry, Altai State Technical University, Barnaul 656099, Russia
    Bioorg Med Chem 14:352-65. 2006
    ..These data suggest the QSAR models developed here may be useful in guiding the design of CXCR2 antagonists from molecular fragments...
  9. ncbi request reprint High-throughput screening for small-molecule activators of neutrophils: identification of novel N-formyl peptide receptor agonists
    Igor A Schepetkin
    Department of Veterinary Molecular Biology, Montana State University, Bozeman, Montana 59717, USA
    Mol Pharmacol 71:1061-74. 2007
    ..These studies enhance our understanding of FPR ligand/receptor interactions and structure/activity relationships of phagocyte agonists...
  10. ncbi request reprint N-benzoylpyrazoles are novel small-molecule inhibitors of human neutrophil elastase
    Igor A Schepetkin
    Department of Veterinary Molecular Biology, Montana State University, Bozeman, Montana 59717, USA
    J Med Chem 50:4928-38. 2007
    ..Thus, N-benzoylpyrazole derivatives represent novel structural templates that can be utilized for further development of efficacious NE inhibitors...
  11. ncbi request reprint Novel small-molecule inhibitors of anthrax lethal factor identified by high-throughput screening
    Igor A Schepetkin
    Department of Veterinary Molecular Biology, Montana State University, Bozeman, Montana 59717, USA
    J Med Chem 49:5232-44. 2006
    ..These novel LF inhibitors and the structural scaffolds identified as important for inhibitory activity represent promising leads to pursue for further LF inhibitor development...