Pharmacophore and three-dimensional quantitative structure activity relationship methods for modeling cytochrome p450 active sites.

Abstract

Structure activity relationships (SAR), three-dimensional structure activity relationships (3D-QSAR), and pharmacophores represent useful tools in understanding cytochrome P450 (CYP) active sites in the absence of crystal structures for these human enzymes. These approaches have developed over the last 30 years such that they are now being applied in… (More)

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Cite this paper

@article{Ekins2001PharmacophoreAT, title={Pharmacophore and three-dimensional quantitative structure activity relationship methods for modeling cytochrome p450 active sites.}, author={Sean Ekins and Marcel J. de Groot and Jeffrey P. Jones}, journal={Drug metabolism and disposition: the biological fate of chemicals}, year={2001}, volume={29 7}, pages={936-44} }