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Navigating High-Dimensional Activity Landscapes: Design and Application of the Ligand-Target Differentiation Map

https://doi.org/10.1021/ci3002765
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What this work says

Outgoing claims: the papers this work cites, builds on, or argues with.

inferredcites →https://doi.org/10.1002/3527603743.ch11openalex-snapshot
Structure Modification in Chemical Databases
inferredcites →https://doi.org/10.1002/cmdc.200900300openalex-snapshot
From Structure–Activity to Structure–Selectivity Relationships: Quantitative Assessment, Selectivity Cliffs, and Key Compounds
inferredcites →https://doi.org/10.1016/j.cbpa.2008.01.044openalex-snapshot
Computational analysis of ligand relationships within target families
inferredcites →https://doi.org/10.1021/ci00057a005openalex-snapshot
SMILES, a chemical language and information system. 1. Introduction to methodology and encoding rules
inferredcites →https://doi.org/10.1021/ci100477mopenalex-snapshot
Design of Multitarget Activity Landscapes That Capture Hierarchical Activity Cliff Distributions
inferredcites →https://doi.org/10.1021/ci200281vopenalex-snapshot
Multitarget Structure–Activity Relationships Characterized by Activity-Difference Maps and Consensus Similarity Measure
inferredcites →https://doi.org/10.1021/ci9800211openalex-snapshot
Chemical Similarity Searching
inferredcites →https://doi.org/10.1021/jm100933wopenalex-snapshot
Activity Landscape Representations for Structure−Activity Relationship Analysis
inferredcites →https://doi.org/10.1021/jm201706bopenalex-snapshot
Exploring Activity Cliffs in Medicinal Chemistry
inferredcites →https://doi.org/10.1038/nchembio.216openalex-snapshot
Target profiling of small molecules by chemical proteomics
inferredcites →https://doi.org/10.1038/nchembio.530openalex-snapshot
Navigating the kinome
inferredcites →https://doi.org/10.1038/nrd2289openalex-snapshot
Targeting dual-specificity phosphatases: manipulating MAP kinase signalling and immune responses
inferredcites →https://doi.org/10.1038/nrd2541openalex-snapshot
High-throughput kinase profiling as a platform for drug discovery
inferredcites →https://doi.org/10.1111/j.1747-0285.2011.01235.xopenalex-snapshot
Representation of Multi‐Target Activity Landscapes Through Target Pair‐Based Compound Encoding in Self‐Organizing Maps
inferredcites →https://doi.org/10.1146/annurev-pharmtox-010510-100553openalex-snapshot
Strategies to Discover Unexpected Targets for Drugs Active at G Protein–Coupled Receptors
inferredcites →https://doi.org/10.4155/fmc.10.293openalex-snapshot
Large-Scale Exploration of Bioisosteric Replacements on the Basis of Matched Molecular Pairs

What points at this work

Incoming claims: where this work appears in other papers’ reference lists and arguments.

inferred← citeshttps://doi.org/10.1002/minf.201300034openalex-snapshot
A Perspective on Computational Chemogenomics
inferred← citeshttps://doi.org/10.1002/minf.201300044openalex-snapshot
Visualization of Activity Landscapes and Chemogenomics Data
inferred← citeshttps://doi.org/10.1002/minf.201300076openalex-snapshot
Using Graph Indices for the Analysis and Comparison of Chemical Datasets
inferred← citeshttps://doi.org/10.1007/978-3-319-93233-0_21openalex-snapshot
SAR/QSAR
inferred← citeshttps://doi.org/10.1016/j.ddtec.2013.01.002openalex-snapshot
Large-scale SAR analysis
inferred← citeshttps://doi.org/10.1021/acs.jcim.8b00661openalex-snapshot
Three-Dimensional Activity Landscape Models of Different Design and Their Application to Compound Mapping and Potency Prediction
inferred← citeshttps://doi.org/10.1021/acsomega.0c03659openalex-snapshot
Quantitative Comparison of Three-Dimensional Activity Landscapes of Compound Data Sets Based upon Topological Features
inferred← citeshttps://doi.org/10.1021/ci300444popenalex-snapshot
Design of a Three-Dimensional Multitarget Activity Landscape
inferred← citeshttps://doi.org/10.1021/jm301292aopenalex-snapshot
Matched Molecular Pair Analysis of Small Molecule Microarray Data Identifies Promiscuity Cliffs and Reveals Molecular Origins of Extreme Compound Promiscuity
inferred← citeshttps://doi.org/10.1039/c6md00108dopenalex-snapshot
Recent developments in SAR visualization
inferred← citeshttps://doi.org/10.1177/1087057114530783openalex-snapshot
Automated Structure–Activity Relationship Mining: Connecting Chemical Structure to Biological Profiles
inferred← citeshttps://doi.org/10.3390/molecules25173952openalex-snapshot
Computational Method for Quantitative Comparison of Activity Landscapes on the Basis of Image Data
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