Drug Metabolism: Databases and High-Throughput Testing During Drug Development

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Drug Metabolism comprises a series of short case studies from the pharmaceutical industry, followed by a series of chapters outlining 'new directions' in the use of drug metabolism databases in pharmaceutical research. The final section describes commercial software for the handling and analysis of metabolism databases. This book represents a significant advance in the use of metabolism data in the discovery and development of new drugs.
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More About This Book

Overview

Drug Metabolism comprises a series of short case studies from the pharmaceutical industry, followed by a series of chapters outlining 'new directions' in the use of drug metabolism databases in pharmaceutical research. The final section describes commercial software for the handling and analysis of metabolism databases. This book represents a significant advance in the use of metabolism data in the discovery and development of new drugs.
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Product Details

  • ISBN-13: 9780632053421
  • Publisher: Wiley, John & Sons, Incorporated
  • Publication date: 3/28/1999
  • Series: IUPAC Chemical Data Ser.
  • Edition number: 1
  • Pages: 352

Table of Contents

Preface
Introduction: Drug Metabolism Data: Past, Present and Future Considerations 2
Metabolism Considerations During the Discovery and Development of Chlorpropamide, Pyrantel, Tetramisol and Certain Alpha-adrenergic Agonists 17
Use of a Metabolism Database During the Development of Zyflo 23
Prediction of Tebufelone Metabolism Using a Metabolism Database Approach 27
Use of Metabolism Databases at Parke-Davis Pharmaceutical Research, Inc. 31
A Perspective on the Use and Role of Metabolic Databases at Pharmacia & Upjohn, Inc. 40
Use of a Metabolism Database at Eli Lilly & Co. 44
Use of a Metabolism Database at Bayer A. G. 50
Construction of a Metabolism Database Emphasizing Human CYP Data at Daiichi Pharmaceutical Co., JP 57
A Prodrug and a Softdrug 62
High-Throughput Screening for Gastrointestinal Absorption in the Generation of SAR Databases 71
Screening for the Effects of Cytochromes P450 on New Drugs and for the Influence of New Drugs on the Cytochromes P450 79
Rationale For The Development Of Databases For The Prediction Of Metabolic Drug Interactions: Experience With Antiepileptic Drugs 122
High-Throughput Screening for Inhibition of Cytochrome P450 Metabolism 129
Three Dimensional Aspects of Metabolism in Human P450 Systems 137
The Use of Microorganisms in the Study of Drug Metabolism 145
Metalloporphyrins as Synthetic Livers 152
Higher-Throughput In Vivo Pharmacokinetic Screening 163
High-Throughput Screening in Preclinical Drug Metabolism: A Burgeoning Trend 170
Statistics-Based Probabilities of Metabolic Possibilities 185
Use of Metabolic Databases to Guide Target Selection for Anti-Microbial Drug Design 192
Comparison of Commercially Available Metabolism Databases During the Design of Prodrugs and Codrugs 208
Soft Drugs: Designing Safer Drugs by Simplifying Drug Metabolism 223
MetabolExpert: Its Use in Metabolism Research and in Combinatorial Chemistry 237
META: A Program for the Prediction of the Products of Mammal Metabolism of Xenobiotics 271
Metabolite 277
Synopsys' Metabolism Database 281
Knowledge Based Expert Systems for Toxicity and Metabolism Prediction 289
Drug Metabolism Databases: Some Key Points 298
App Table I. Commercially Available Drug Metabolism Databases 304
App Table II. High-Throughput Metabolism Contract Research Organizations 305
Glossary 307
Epilogue 320
List of Authors 322
List of Drugs and Terms 327
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