Chapter 1 A Survey of Web-Based Chemogenomic Data Resources

Chapter 2 Finding Potential Multitarget Ligands Using PubChem

Chapter 3 Fundamental Bioinformatic and Chemoinformatic Data Processing

Chapter 4 Parsing Compound–Protein Bioactivity Tables

Chapter 5 Impact of Molecular Descriptors on Computational Models

Chapter 6 Physicochemical Property Labels as Molecular Descriptors for Improved Analysis of Compound–Protein and Compound–Compound Networks

Chapter 7 Core Statistical Methods for Chemogenomic Data

Chapter 8 Structure-Based Detection of Orthosteric and Allosteric Pockets at Protein–Protein Interfaces

Chapter 9 Single Binding Pockets Versus Allosteric Binding

Chapter 10 Mapping Biological Activities to Different Types of Molecular Scaffolds: Exemplary Application to Protein Kinase Inhibitors

Chapter 11 SAR Matrix Method for Large-Scale Analysis of Compound Structure–Activity Relationships and Exploration of Multitarget Activity Spaces

Chapter 12 Linear and Kernel Model Construction Methods for Predicting Drug–Target Interactions in a Chemogenomic Framework

Chapter 14 A Platform for Comprehensive Genomic Profiling in Human Cancers and Pharmacogenomics Therapy Selection

Chapter 15 The Future of Computational Chemogenomics