Data Exploration
SARkush®
Automated SAR Analysis via Markush like Structures
SARkush® aids structure activity relationship (SAR) analysis of compound datasets by automatically clustering compounds into Markush-like (SARkush) structures.
A module within the MCPairs platform.
How SARkush® Works
SARkush in Three steps
Input File
Submit a file with compounds and data.
Prepare Search
Submit job or refine settings further for pair finding and clustering.
Review Results
Automatically downloads results and displays them in a grid form with R-group decomposition.
Explore SARkush®
Powerful analysis at your fingertips
Simple Automation
Automatically cluster compounds into Markush-like (SARkush) structures.
Time Saving
Remove the need for users to separate compounds into chemical series and cores.
Clear Grid Display
Generate SARkush structure depictions and compound decomposition tables.
Why use SARkush®?
Key Benefits
Summarise Project Data
Automatically clusters compounds based on Matched Molecular Pair (MMP)-networks and generic-atom scaffolds, and generates Markush-like depictions and decomposition tables.
In-Depth Analysis
Speed up patent filing and reduce transcription errors. Analyse competitor patents.
Deeper Modelling
Use the output for further computational models (Free-Wilson, QSAR, etc.).
Desymmetrised Ring
Ensure similar R-groups are reported the same way to add clarity and consistency.
Web-based Access
Access SARkush® through MCPairs Online from any modern web browser—no software installation required.
