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Molecular Modeling of P-Glycoprotein and Related Drugs

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2005

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Pajeva, Ilza
Fleischer, Romy
Tsakovska, Ivanka
Wiese, Michael

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https://doi.org/10.1007/s00044-005-0127-x
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Medicinal Chemistry Research. 2005, 14(2), pp. 106-117. ISSN 1054-2523. eISSN 1554-8120. Available under: doi: 10.1007/s00044-005-0127-x

Zusammenfassung

This paper summarizes the results from molecular modeling of various multidrug resistance (MDR) modulators and the MDR protein P-glycoprotein (P-gp). Highly predictive 3D-QSAR models are obtained that can be used for anti-MDR activity prediction. The pharmacophore patterns of various drugs are identified. Models of P-gp are developed and a hypothesis for P-gp functioning is proposed.

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540 Chemie

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ISO 690PAJEVA, Ilza, Christoph GLOBISCH, Romy FLEISCHER, Ivanka TSAKOVSKA, Michael WIESE, 2005. Molecular Modeling of P-Glycoprotein and Related Drugs. In: Medicinal Chemistry Research. 2005, 14(2), pp. 106-117. ISSN 1054-2523. eISSN 1554-8120. Available under: doi: 10.1007/s00044-005-0127-x
BibTex
@article{Pajeva2005-02Molec-38290,
  year={2005},
  doi={10.1007/s00044-005-0127-x},
  title={Molecular Modeling of P-Glycoprotein and Related Drugs},
  number={2},
  volume={14},
  issn={1054-2523},
  journal={Medicinal Chemistry Research},
  pages={106--117},
  author={Pajeva, Ilza and Globisch, Christoph and Fleischer, Romy and Tsakovska, Ivanka and Wiese, Michael}
}
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