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Innovations in Bioinformatics: Emerging Tools for Drug Discovery and Development

Published by: Business Insights

Published: Jan. 1, 2008 - 253 Pages


Table of Contents


Innovations in Bioinformatics: Emerging tools for drug discovery and development

Executive Summary

Bioinformatics in the omics era

Genomics and related ‘omics

Proteomics

Metabolomics and systems biology

Knowledge management solutions

Profiles of selected companies

Trends and opportunities

Chapter 1 Bioinformatics in the omics era

What is bioinformatics?

End-users of bioinformatics tools and services

Life sciences in the omics era

Overview of omics

Genomics

Pharmacogenomics

Transcriptomics

Proteomics

Metabolomics

Other omics

Background on drug discovery and development

Types of drugs under development

Small molecules

Protein-based biotherapies

Nucleic acid-based biotherapies

The drug discovery and development process

Stages (US)

Role of biomarkers

Bioinformatics in drug discovery and development

From biological data to drug knowledge

Chapter 2 Genomics and related omics

Summary

Background

Categories of genomic analysis

Sequencing

Next-generation sequencing

Genotyping and gene expression

DNA microarrays

Value of genomic analysis to the drug industry

Bioinformatics solutions

Analysis of sequencing data

Sequence databases

Sequence search tools

Multiple sequence alignment tools

Focus on RNAs

Genome finishing and annotating

Microarray platforms

Affymetrix

Illumina

Agilent Technologies

Applied Biosystems

Genome-wide association studies

Other advances

Chapter 3 Proteomics

Summary

Background

Categories of proteomic analysis

Protein separation

Protein identification

Mass spectrometry

Protein microarrays

Structure determination

Value of proteomic analysis to the drug industry

Bioinformatics solutions

Analysis of sequencing data

Sequence databases

Sequence search tools

Multiple sequence alignment tools

In silico drug discovery

Data analysis and integration

Agilent Technologies

Applied Biosystems

BioWisdom

Bruker Daltonics

Geneva Bioinformatics

GeneLogics

Health Discovery Corporation

Nonlinear Dynamics

Sage-N Research

Thermo Scientific

Vermillion

Chapter 4 Metabolomics and Systems Biology

Summary

Background

Metabolomics

Introduction

Value to the drug industry

Commercial bioinformatics solutions

Systems biology

Introduction

Value to the drug industry

Initiatives at Big Pharma

Approaches

In silico mathematical models

The Systems Biology Markup Language

Publicly available modeling software

Commercial pathway analysis tools

Ariadne Genomics

GeneGo

Ingenuity Systems

Commercial modeling technologies

BG Medicine

Cellnomica

Compugen

CuraGen

Entelos

Genstruct

Genomatix

Genomatica

Gene Network Sciences

Health Discovery Corporation

Merrimack Pharmaceuticals

Physiomics

Chapter 5 Knowledge Management Solutions

Summary

Introduction

Providers of high-performance computing

Providers of storage systems

Web-based solutions

Ontologies

Knowledge sharing

The Semantic Web

Software to support R&D labs

Abrevity

Accelrys

Agilent Technologies

BioWisdom

CambridgeSoft

Elsevier MDL

Geospiza

GeneLogics

IO Informatics

KOOPrime

LabVantage

MathWorks

NextBio

Oracle

SAS

Symyx

Teranode

Thermo Fisher Scientific

Text searching and mining

QUOSA

Linguamatics

Inforsense

Insightful

Nervana

Velocity

Clinical trials solutions

Adobe Systems

Infosys

Oracle

Pharsight

Chapter 6 Profiles of selected companies

Summary

Accelrys Inc

Company overview

Bioinformatics tools and services

Bioinformatics-related collaborations

Affymetrix Inc

Company overview

Bioinformatics tools and services

Agilent Technologies Inc

Company overview

Bioinformatics tools and services

Avalon Pharmaceuticals Inc

Company overview

Bioinformatics-related collaborations

BG Medicine Inc

Company overview

Bioinformatics tools and services

BioWisdom Ltd

Company overview

Bioinformatics tools and services

Caliper Life Sciences Inc

Company overview

Bioinformatics tools and services

Compugen Ltd

Company overview

Bioinformatics tools and services

Bioinformatics-related collaborations

CuraGen Corporation

Company overview

Bioinformatics tools and services

Entelos Inc

Company overview

Bioinformatics tools and services

Genstruct Inc

Company overview

Bioinformatics tools and services

Bioinformatics-related collaborations

Gene Network Sciences Inc

Company overview

Bioinformatics tools and services

Bioinformatics-related collaborations

GeneGo Inc

Company overview

Bioinformatics tools and services

Bioinformatics-related collaborations

Health Discovery Corporation

Company overview

Bioinformatics tools and services

Illumina Inc

Company overview

Bioinformatics tools and services

Bioinformatics-related collaborations

Ingenuity Systems Inc

Company overview

Bioinformatics tools and services

Bioinformatics-related collaborations

Insightful Corp

Company overview

Bioinformatics tools and services

Bioinformatics-related collaborations

NextBio

Company overview

Bioinformatics tools and services

Bioinformatics-related collaborations

SAS Institute Inc

Company overview

Bioinformatics tools and services

Bioinformatics-related collaborations

Vermillion Inc

Company overview

Bioinformatics tools and services

Chapter 7 Trends and opportunities

Summary

End-user needs and sentiment

Emerging trends in market evolution

Bioinformatics-enabled biomarker discovery

The promise of Semantic Web technology

Facilitating implementation of IT systems

Market snapshot and forecasts

Genomics and related omics

Proteomics

Systems biology

Life science enterprise knowledge management

Market estimates

Chapter 8 Appendix

Research methodology

Index

List of Figures

Figure 2.1: An entry from Entrez GENE, the US NCBI's web-based interface to GENBANK

Figure 2.2: Genomic context of the myostatin gene (GDF8) using the NCBI Map Viewer

Figure 2.3: Search page of microInspector

Figure 2.4: Search page of the miRNA database (miRBase)

Figure 2.5: miRBase Targets database, a new resource for predicting miRNA targets in animals

Figure 2.6: Predicted Human Genomic Targets for the hsa-let-7g* miRNA

Figure 2.7: Dharmacon siRNA Designer Search Page

Figure 3.8: Advanced Search page of the Protein Data Bank (PDB), the central repository for 3D protein structure information

Figure 3.9: PDB Entry for the complex of the acetylcholine receptor with carbamylcholine (1UV6)

Figure 3.10: Results of a search in the UniProt KnowledgeBase (Swiss-PROT and TrEMBL) for MAP kinase phosphatases

Figure 3.11: Partial UniProt record for Dual Specificity Protein Phosphatase 4 (DUSP4) / MAP

Kinase Phosphatase 2

Figure 3.12: UniProt Feature Aligner for Dual Specificity Protein Phosphatase 4 (DUSP4)

Figure 3.13: UniProt sequences at least 90% similar to Dual Specificity Protein Phosphatase 4 (DUSP4)

Figure 3.14: Front page of the Protein Kinase Resource, University of California at San Diego

Figure 3.15: UniProt sequences at least 90% similar to Dual Specificity Protein Phosphatase 4 (DUSP4)

Figure 4.16: Genomatica's SimPheny™ Systems Biology Model Development Process

List of Tables

Table 2.1: Bioinformatic Analyses of DNA/RNA Sequences

Table 2.2: Contribution of Bioinformatics to Genomics-Based Drug Discovery

Table 2.3: Databases and On-line Tools for Analyzing DNA Sequences and Signals

Table 2.4: Leading Sequence Comparison Servers

Table 2.5: BLAST Applications and Flavors

Table 2.6: Online Pairwise Alignment Programs

Table 2.7: Multiple Sequence Alignment Tools

Table 2.8: RNA Secondary Structure Prediction

Table 2.9: miRNA and siRNA Resources

Table 2.10: Selected genome-sequencing packages

Table 2.11: Phylogeny and Orthology

Table 2.12: Summary of patent-related genes in the major organisms

Table 3.13: Role of Bioinformatics in Protein Diagnostics and Therapeutics

Table 3.14: Selected Protein Databases

Table 3.15: On-line tools to test for protein transmembrane segments

Table 3.16: Principal Protein Domain Recognition Resources

Table 3.17: Protein Structure Prediction

Table 4.18: Software for Systems Biology

Table 7.19: World Bioinformatics Market, 2006-2011

Abstract

R&D laboratories are co-ordinating the analysis of increasing volumes of disparate biological data, largely comprised of gene and protein sequences. Bioinformatics-enabled data management has enabled companies to improve productivity within their R&D programmes by identifying new drug targets, diagnostic biomarkers and biomarkers of drug efficacy and toxicity. From a systems biology approach, bioinformatics combine data into interactive models to highlight disease pathways and aid the discovery of on off-target effects of compounds. Knowledge management solutions are crucial in both instances, enabling project teams to make informed decisions about potential new drugs.

'Innovations in Bioinformatics' is a new report published by Business Insights that provides a detailed analysis of bioinformatic developments and applications. This report examines the bioinformatic tools used to manage high-throughput data from omic technologies, systems biology modelling and biomarker discovery. Knowledge management solutions are reviewed and the provisions of major bioinformatics contributors are highlighted.

This report also provides forecasts for bioinformatic tools and services to 2011. Use this new report to identify the latest developments in bioinformatics, assess the tools and platforms that can improve drug developments and benchmark effective implementation strategies.

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