- Commercial Software includes industry-leading platforms such as Leadscope Model Applier, MultiCASE and Lhasa Nexus (Derek and Sarah).
- Freeware Tools includes (but not limited to) OECD QSAR Toolbox, Vega, OPERA, EpiSuite, Toxtree, and SwissADME.
Toxicological Risk Assessment: at Innovatune we integrate traditional toxicological approaches with advanced computational tools, including artificial intelligence and machine learning (e.g., QSAR), to deliver comprehensive, customized solutions that meet regulatory standards. Our expertise ensures a robust, evidence-based approach to support your safety and compliance needs.
Software supporting QSAR and read-across
Selected key services
- Genotoxic drug impurity assessment aligned with ICH M7 guidelines, including QSAR analysis, Acceptable Intake or PDE-based carcinogenic limit derivation, and less-than-lifetime (LTL) exposure assessment
- N-Nitrosamine impurity assessment including carcinogenic potency prediction of NDSRI and small-molecule N-nitrosamines
- Non-genotoxic impurity qualification using QSAR and read-across for data-poor substances ensuring compliant safety evaluations even in the absence of extensive experimental data
- In silico (QSAR) screening for candidate risk assessment, covering potential genotoxicity, carcinogenicity, cardiotoxicity, reproductive and developmental toxicity, organ toxicity, skin and eye irritation, skin sensitization, acute toxicity, endocrine activity, and neurotoxicity to enhance safe drug development and decision-making
- PDE limit setting for cleaning validation processes
- Summarization of toxicity, ADME and pharmacology data supporting weight-of-Evidence assessments