Dr. Igor V. Tetko
Helmholtz Zentrum Muenchen
Institute of Structural Biology
Ingolstaedter Landstrasse 1, b. 60w
85764 Neuherberg (bei Munich)
Tel: +49 (0)89 3187-3575
Fax: +49 (0)89 3187-3585

CADASTER FP7 grant
MC ITN "Environmental ChemOinformatics"
VCCLAB: Virtual Computational Chemistry Laboratory

Professional occupation and education

   2012 - now: Chemoinformatics Group Leader, Institute of Structural Biology, HMGU
   2011 - now: CSO, eADMET GmbH
   2001 - 2011: Senior Research Scientist/Group Leader, HMGU - National Research Centre for Environment and Health, Institute for Bioinformatics, MIPS
   2000 - 2001: Premier Assistant, Laboratory of Neuroheuristic, Institut de Physiologie, Universite de Lausanne, Switzerland
   1997 - 1999: Assistant Diplome, Laboratory of Neuroheuristics, Institut de Physiologie, Universite de Lausanne, Switzerland
   1996 - 1997: Postdoc, Laboratoire de Neuroheuristique, Institut de Physiologie, Universite de Lausanne, Switzerland
   1995 - now: Senior Research Scientist, Biomedical Department, Institute of Bioorganic & Petrochemistry, Kyiv, Ukraine
   1994 - 1995: SNSF grant 7-UKPJ-041507, Laboratoire de Neuro-Heuristique, Institut de Physiologie, Universite de Lausanne, Switzerland
   1994 - 1995: Research Scientist, Biomedical Department, Institute of Bioorganic & Petrochemistry, Kyiv, Ukraine
   1994: Candidate of Sciences (Ph.D.) in Chemistry, Doctoral thesis "Application of Artificial Neural Networks in Structure-Activity Relationship Studies"
   1989 - 1994: Ph.D. student, supervisor Prof. A.I. Luik, Biomedical Department, Institute of Bioorganic & Petrochemistry, Kyiv, Ukraine
   1989: M.S. in Physics Computer Sciences (cum laude), Faculty of Physical & Chemical Biology, Moscow Institute of Physics and Technology
   1983 - 1989: student, Faculty of Physical & Chemical Biology, Moscow Institute of Physics and Technology

PubMed listing
Representative by years
DBLP Bibliography Server listing (computer science ++)

Several recent studies

  • Mannhold, R.; Poda, G.I.; Ostermann, C.; Tetko, I.V. Calculation of molecular lipophilicity: State-of-the-art and comparison of log P methods on more than 96,000 compounds, J. Pharm. Sci., 2009, 98, 861-93, download pre-print.
  • Tetko, I. V.; Bruneau, P.; Mewes, H. W.; Rohrer, D. C.; Poda, G. I. Can we estimate the accuracy of ADME-Tox predictions?, Drug Discov. Today, 2006, 11, 700-7, download pre-print.
  • Tetko, I. V. Computing chemistry on the web, Drug Discov. Today, 2005, 10, 1497-500, download pre-print.
  • Poda, G. I.; Tetko, I. V.; Rohrer, D. C. Towards predictive ADME profiling of drug candidates: Lipophilicity and solubility, In 229th American Chemical Society National Meeting & Exposition; ACS: San Diego, CA, 2005, MEDI 514 download poster.