Towards integrated ADME prediction: past, present and future directions for modelling metabolism by UDP-glucuronosyltransferases.

@article{Smith2004TowardsIA,
  title={Towards integrated ADME prediction: past, present and future directions for modelling metabolism by UDP-glucuronosyltransferases.},
  author={Paul A. Smith and Michael J. Sorich and L. S. Low and Ross A. McKinnon and John O. Miners},
  journal={Journal of molecular graphics & modelling},
  year={2004},
  volume={22 6},
  pages={507-17}
}
Undesirable absorption, distribution, metabolism, excretion (ADME) properties are the cause of many drug development failures and this has led to the need to identify such problems earlier in the development process. This review highlights computational (in silico) approaches that have been used to identify the characteristics of ligands influencing molecular recognition and/or metabolism by the drug-metabolising enzyme UDP-gucuronosyltransferase (UGT). Current studies applying pharmacophore… CONTINUE READING

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Highly Influenced

In silico insights : chemical and structural characteristics associated with UDP - glucuronosyltransferase ( UGT ) substrate selectivity

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Miners, In silico insights: chemical and structural characteristics associated with UDP-glucuronosyltransferase (UGT) substrate selectivity

P. A. Smith, M. J. Sorich, J.O.R.A. McKinnon
Clin. Exp. Pharmacol. Physiol • 2003
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