Software and AI companies at ACT 2026

Nov 15–18, 2026 San Antonio, TX ~1.4k attendees Website

18 software and AI companies are at ACT 2026 — 29 presentations on the program and 9 with a booth in the exhibit hall. Most represented: Human Chemical (3 on the program), Schrödinger (2 on the program), Certara (1 on the program). 13 of them have their own page in this guide. As of Oct 8, 2026.

All 231 organizations at ACT 2026 →

Showing 1–14 of 18 organizations

Organization	ACT 2026 Attendance
Human Chemical
humanchemical.com Software and AI companies Builds specialized AI agents for toxicology and regulatory work: in silico hazard prediction, PBPK modeling and drafting regulatory documents.	Session Sun Nov 15 8:00am–11:30am From Predictive Models to Collaborative Intelligence: The Role of Agentic AI in the Future of Toxicology (CE2) In silico and AI · with Boehringer Ingelheim 8:00amWelcome and Course Overview (CE2-1)Human Chemical 8:05amAgentic AI 101: A Primer for Drug Discovery and Development Toxicologists (CE2-2)Taiho Oncology 8:30amAgentic AI Frameworks for Predictive Toxicology-Based Literature Searches (CE2-3)Coincidence Labs 9:00amSynthesizing Experimental Results and In-Silico Predictions for Autonomous Hypothesis Generation (CE2-4)Human Chemical 10:00amLeveraging Agentic AI to Reassess and Optimize Previously Failed Compounds (CE2-5)Ignota Labs 10:30amChemistry Foundation Models for Optimal Drug Design (CE2-6)deepmirror Talk Sun Nov 15 8:00am–8:05am Part of From Predictive Models to Collaborative Intelligence: The Role of Agentic AI in the Future of Toxicology (CE2) Welcome and Course Overview (CE2-1) In silico and AI Talk Sun Nov 15 9:00am–9:30am Part of From Predictive Models to Collaborative Intelligence: The Role of Agentic AI in the Future of Toxicology (CE2) Synthesizing Experimental Results and In-Silico Predictions for Autonomous Hypothesis Generation (CE2-4) In silico and AI Talk Mon Nov 16 9:50am–10:15am Part of The Role of Professional Judgment in Toxicology amidst the Rise of Artificial Intelligence and Computational Tools (S02) When AI Gets It Wrong: Interpreting Predictive Models from Omics and High-Content Data (S02-4) In silico and AI Talk Tue Nov 17 9:05am–9:30am Part of Next-Generation Liver Toxicity Assessment: Integrating Human-Relevant NAMs, AI, and Exposure Modeling (S07) An Integrated NAM Platform Combining Bioactivity Prediction with PBPK and Literature Intelligence for Chemical Liver Toxicity Assessment (S07-2) New approach methods · In silico and AI
Schrödinger New York, NY
schrodinger.com Software and AI companies Computational chemistry software company that also develops its own drugs; presents physics-based genotoxicity screening and preclinical toxicity work.	Poster Mon Nov 16 5:00pm–6:30pm Physics-Based, Molecular Dynamics Screening as a Tier-1 Filter for DNA Minor Groove Binding Genotoxicity (P432) Nelson Exhibit Ballroom · Poster P432 Genetic toxicology · In silico and AI Poster Mon Nov 16 5:00pm–6:30pm Preclinical Toxicity Assessment and Dosing Schedule Optimization of SGR-2921, a Small Molecule Inhibitor of CDC7 (P433) Nelson Exhibit Ballroom · Poster P433 Translational safety
Certara Radnor, PA
certara.com Software and AI companies Biosimulation software and services company; for nonclinical teams it offers SEND data tools such as SEND Explorer.	Booth Exhibiting at Booth 719 Mon, Nov 169:30am–6:30pmTue, Nov 178:00am–4:30pm Session Mon Nov 16 9:00am–12:00pm The Role of Professional Judgment in Toxicology amidst the Rise of Artificial Intelligence and Computational Tools (S02) In silico and AI · with National Institutes of Health 9:00amIntroduction (S02-1)National Institutes of Health 9:05amEnhancing Toxicological Literature Review through AI and Expert Insight (S02-2)ToxStrategies 9:25amNo Spreadsheet Left Unharmonized: A Human-in-the-Loop Framework for AI-Assisted Toxicology Data Extraction and Standardization (S02-3)Certara 9:50amWhen AI Gets It Wrong: Interpreting Predictive Models from Omics and High-Content Data (S02-4)Human Chemical 10:45amChemical Similarity in Practice: Navigating Endpoint-Agnostic and Endpoint-Specific Approaches (S02-5)National Institutes of Health 11:15amIntegrating Artificial Intelligence and Professional Expertise in Structure-Activity Assessments (S02-6)Inductive Bio Talk Mon Nov 16 9:25am–9:50am Part of The Role of Professional Judgment in Toxicology amidst the Rise of Artificial Intelligence and Computational Tools (S02) No Spreadsheet Left Unharmonized: A Human-in-the-Loop Framework for AI-Assisted Toxicology Data Extraction and Standardization (S02-3) In silico and AI · Study data Talk Mon Nov 16 2:30pm–2:55pm Part of Safety and Regulatory Roadmap for Immune Engagers: Strategies to Translate Novel Modalities (S05) Translating NAMs to First-in-Human Dose Selection and Regulatory Acceptance (S05-3) Translational safety · New approach methods Talk Tue Nov 17 8:00am–8:55am From Data to Decisions: How AI Will Inform Toxicologic Interpretation of SEND Data Grand Oaks Ballroom R Study data · In silico and AI
Instem Boston, MA	◆Gold Supporter
instem.com Software and AI companiesGold Supporter Software and services for preclinical study management, SEND data creation and review, and in silico safety prediction.	Booth Exhibiting at Booth 407 Mon, Nov 169:30am–6:30pmTue, Nov 178:00am–4:30pm Talk Sun Nov 15 12:00pm–12:55pm Not Necessarily Validated: What Makes NAM Data Reviewable Grand Oaks Ballroom Q New approach methods · Regulatory Talk Tue Nov 17 2:40pm–3:15pm Part of Safety Assessment of Extractables and Leachables under the New ICH Q3E Guideline (S11) Assessing the Data Landscape of Extractables and Leachables and Implications for Read Across Strategies (S11-3) Chemical risk assessment · In silico and AI
MultiCASE Mayfield Heights, OH
multicase.com Software and AI companies Computational toxicology software and consulting for QSAR predictions, including ICH M7 assessments of drug impurities and REACH chemical evaluations.	Booth Exhibiting at Booth 410 Mon, Nov 169:30am–6:30pmTue, Nov 178:00am–4:30pm Poster Mon Nov 16 5:00pm–6:30pm Identifying Undetected Genotoxic Potential in Ames-Negative Compounds: A Statistical QSAR Model Coupled with Mechanism-Based Expert Rules (P519) Nelson Exhibit Ballroom · Poster P519 Genetic toxicology · In silico and AI Talk Tue Nov 17 12:00pm–12:55pm In Silico Read-Across Tools for Diverse Toxicity Endpoints Grand Oaks Ballroom Q In silico and AI
ESQlabs Saterland, Germany
esqlabs.com Software and AI companies German modeling firm offering consulting, software and training in PBPK and systems pharmacology models, plus chemical risk assessment.	Poster Mon Nov 16 5:00pm–6:30pm Extending a PBK-QST Platform for Mechanism-Dependent Thyroid Hormone Disruption across Chemicals and Species (P208) Nelson Exhibit Ballroom · Poster P208 In silico and AI · Chemical risk assessment Talk Tue Nov 17 10:45am–11:05am Part of Next-Generation Liver Toxicity Assessment: Integrating Human-Relevant NAMs, AI, and Exposure Modeling (S07) From Exposure Dynamics to Uncertainty: A Hybrid Framework for Drug-Induced Liver Injury Prediction (S07-5) In silico and AI · New approach methods
Sciome Research Triangle Park, NC
sciome.com Software and AI companies Research software and data science company building computational toxicology, QSAR and AI tools, including automated toxicity and property prediction.	Talk Sun Nov 15 2:00pm–2:30pm Part of Quantitative Structure–Activity Relationship Demystified: Foundations, Best Practices, Regulatory Use, and Practical Applications (CE8) Integrating QSAR Modeling and Weight-of-Evidence into Read-Across Frameworks (CE8-4) In silico and AI Poster Mon Nov 16 5:00pm–6:30pm ChemHydra: Automated AI-Driven Pipeline for ADME, Physicochemical, and Toxicity Endpoint Prediction Integrating Advanced Chemical Characterization (P511) Nelson Exhibit Ballroom · Poster P511 In silico and AI
AxiomBio San Francisco, CA
axi.om Software and AI companies Builds AI models that predict drug toxicity, including liver injury, from human cell data instead of animal studies.	Booth Exhibiting at Booth 110 Mon, Nov 169:30am–6:30pmTue, Nov 178:00am–4:30pm Poster Mon Nov 16 5:00pm–6:30pm Human Hepatocyte Multimodal Phenomics Differentiates Mechanistically Distinct Liver Injury Liabilities within Therapeutic Classes (P420) Nelson Exhibit Ballroom · Poster P420 New approach methods
Sable Bio London, UK
sablebio.com Software and AI companies London software company whose Sable Target Intelligence platform assesses target-driven safety risk by integrating genetic, clinical, model and literature evidence.	Booth Exhibiting at Booth 612 Mon, Nov 169:30am–6:30pmTue, Nov 178:00am–4:30pm Poster Mon Nov 16 5:00pm–6:30pm Extracting Target Safety Relationships from Scientific Literature: How to Scale Machine Learning for Preclinical Safety Assessment (P417) Nelson Exhibit Ballroom · Poster P417 In silico and AI
Coincidence Labs
coincidencelabs.com Software and AI companies Builds AI agent systems for pharma that connect a company's existing data to automate work such as regulatory documentation.	Talk Sun Nov 15 8:30am–9:00am Part of From Predictive Models to Collaborative Intelligence: The Role of Agentic AI in the Future of Toxicology (CE2) Agentic AI Frameworks for Predictive Toxicology-Based Literature Searches (CE2-3) In silico and AI
deepmirror
deepmirror.ai Software and AI companies AI drug-design company whose platform helps chemists generate and prioritize small molecules with better ADMET, PK and potency profiles.	Talk Sun Nov 15 10:30am–11:00am Part of From Predictive Models to Collaborative Intelligence: The Role of Agentic AI in the Future of Toxicology (CE2) Chemistry Foundation Models for Optimal Drug Design (CE2-6) In silico and AI
F FlashPath
Software and AI companies Company presenting a data-driven analysis of which preclinical toxicity findings predict adverse events in people.	Poster Mon Nov 16 5:00pm–6:30pm Data-Driven Preclinical Toxicity Syndromes Reveal Which Animal Findings Translate to Human Adverse Events (P412) Nelson Exhibit Ballroom · Poster P412 Translational safety · Study data
Inductive Bio
inductive.bio Software and AI companies AI drug-discovery company that embeds in drug programs, combining predictive models, lab robotics and chemists to design preclinical experiments.	Talk Mon Nov 16 11:15am–11:45am Part of The Role of Professional Judgment in Toxicology amidst the Rise of Artificial Intelligence and Computational Tools (S02) Integrating Artificial Intelligence and Professional Expertise in Structure-Activity Assessments (S02-6) In silico and AI
Metisox
metisox.com Software and AI companies AI and machine learning firm offering life science data analysis, biomarker discovery and carcinogenicity risk assessment software and services.	Poster Mon Nov 16 5:00pm–6:30pm Accelerating Immunotherapy Development with Multi-Target-Driven Safety Evaluation (P507) Nelson Exhibit Ballroom · Poster P507 Immunotoxicology

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Not affiliated with or endorsed by the American College of Toxicology (ACT). Organization details are derived from ACT’s published program, exhibitor floor plan and supporter list, and each organization’s own website. Submit a correction

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