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Computational Drug Safety & PKPD Modeling
Showing 78 results
Clinical Development Module logo
Clinical Development Module

by Quanthealth

Clinical trial simulation and protocol optimization for pharma drug development, with AI-powered indication selection, enrollment prediction, and probability of technical success.

Computational Drug Safety & PKPD Modeling
Clinical Trial Simulation & Forecasting
Business Development Module logo
Business Development Module

by Quanthealth

Clinical trial simulation and asset evaluation for in-licensing, out-licensing, and business development decision-making.

Computational Drug Safety & PKPD Modeling
Clinical Trial Simulation & Forecasting
Portfolio Management Module logo
Portfolio Management Module

by Quanthealth

Asset prioritization and portfolio optimization for clinical development programs using predictive modeling and study analytics.

Computational Drug Safety & PKPD Modeling
Clinical Trial Simulation & Forecasting
Trial Optimizer logo
Trial Optimizer

by PhaseV Trials

AI-powered clinical trial design optimization that simulates millions of adaptive and Bayesian designs to reduce sample sizes and costs across Phase 1–3 studies.

Computational Drug Safety & PKPD Modeling
Clinical Trial Simulation & Forecasting
Response Optimizer logo
Response Optimizer

by PhaseV Trials

Heterogeneous treatment effect analysis and causal inference for clinical trial optimization, patient stratification, and recruitment.

Computational Drug Safety & PKPD Modeling
Clinical Trial Simulation & Forecasting
Portfolio Optimizer logo
Portfolio Optimizer

by PhaseV Trials

Causal disease modeling to quantify biomarker impact on clinical outcomes and simulate treatment scenarios for R&D decisions.

Computational Drug Safety & PKPD Modeling
Clinical Trial Simulation & Forecasting
DrugSuccess.Ai logo
DrugSuccess.Ai

by ThinkBio.Ai

Predictive intelligence for therapeutic success, integrating multi-omics, genetics, and preclinical data to optimize target selection and reduce R&D risk.

Computational Drug Safety & PKPD Modeling
Clinical Trial Simulation & Forecasting
GEM-1 logo
GEM-1

by Synthesize Bio

Gene expression modeling to predict human tissue responses, de-risk clinical trials, and optimize patient selection.

Computational Drug Safety & PKPD Modeling
Clinical Trial Simulation & Forecasting
Syntensor Terminal logo
Syntensor Terminal

by Syntensor

Predict clinical trial outcomes for small molecules with >80% accuracy using simulated potency and ADMET assays combined with mechanism of action and trial design data.

Computational Drug Safety & PKPD Modeling
Clinical Trial Simulation & Forecasting
QikProp logo
QikProp

by Schrödinger

Rapid ADME predictions for small-molecule drug candidates based on 3D molecular structure.

Computational Drug Safety & PKPD Modeling
In Silico Toxicology & Safety Prediction
Q-Models logo
Q-Models

by Quantori

Predictive ADMET and property modeling with 175+ machine learning models for small-molecule drug discovery and optimization.

Computational Drug Safety & PKPD Modeling
In Silico Toxicology & Safety Prediction
Trial Accelerator logo
Trial Accelerator

by Phesi

Predictive modeling and site selection for clinical trial design using real-world data from the world's largest trials database.

Computational Drug Safety & PKPD Modeling
Clinical Trial Simulation & Forecasting
Phase Advance Predictive Technology Platform logo
Phase Advance Predictive Technology Platform

by Phase Advance AI

AI-driven biomechanical modeling to predict drug efficacy and commercial potential 7–14 years before clinical trials.

Computational Drug Safety & PKPD Modeling
Clinical Trial Simulation & Forecasting
East Horizon Platform for Trial Design logo
East Horizon Platform for Trial Design

by Cytel

Trial design and simulation using adaptive and Bayesian methods to optimize protocols and accelerate drug development.

Computational Drug Safety & PKPD Modeling
Clinical Trial Simulation & Forecasting
Cytocast Screener, Cytocast Optimizer, and Cytocast Nominator logo
Cytocast Screener, Cytocast Optimizer, and Cytocast Nominator

by Cytocast

AI-powered drug side-effect prediction using Digital Twin technology for early candidate prioritization.

Computational Drug Safety & PKPD Modeling
In Silico Toxicology & Safety Prediction
Cytocast Digital Twin Platform logo
Cytocast Digital Twin Platform

by Cytocast

Protein complex simulation and AI-powered off-target and side effect prediction for drug safety assessment.

Computational Drug Safety & PKPD Modeling
In Silico Toxicology & Safety Prediction
Digital Extruder logo
Digital Extruder

by PIPA LLC

Simulation and optimization for food formulation, extrusion processing, and sensory outcomes using AI and computational modeling.

Computational Drug Safety & PKPD Modeling
Physiologically-Based PK Modeling (PBPK) & Systems Pharmacology
Digital Fermentor logo
Digital Fermentor

by PIPA LLC

Virtual fermentation modeling for optimizing yield, consistency, and sensory attributes in biochemical production.

Computational Drug Safety & PKPD Modeling
Physiologically-Based PK Modeling (PBPK) & Systems Pharmacology
Beacon-1 logo
Beacon-1

by Inductive Bio

AI-powered ADMET prediction across 13 endpoints including solubility, permeability, stability, and toxicity.

Computational Drug Safety & PKPD Modeling
In Silico Toxicology & Safety Prediction
EVA logo
EVA

by Scienta Lab

Predictive modeling of human immune response for immunology and inflammation drug development, from target selection through clinical trial design.

Computational Drug Safety & PKPD Modeling
Clinical Trial Simulation & Forecasting