Development of decision tree models for substrates, inhibitors, and inducers of p-glycoprotein.

@article{Hammann2009DevelopmentOD,
  title={Development of decision tree models for substrates, inhibitors, and inducers of p-glycoprotein.},
  author={Felix Hammann and Helmuth Gutmann and Ursula Jecklin and Andreas Maunz and Christoph Helma and Juergen Drewe},
  journal={Current drug metabolism},
  year={2009},
  volume={10 4},
  pages={
          339-46
        }
}
In silico classification of new compounds for certain properties is a useful tool to guide further experiments or compound selection. Interaction of new compounds with the efflux pump P-glycoprotein (P-gp) is an important drug property determining tissue distribution and the potential for drug-drug interactions. We present three datasets on substrate, inhibitor, and inducer activities for P-gp (n = 471) obtained from a literature search which we compared to an existing evaluation of the… CONTINUE READING
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