Best of Both Worlds: An Expansion of the State of the Art pKa Model with Data from Three Industrial Partners

Best of Both Worlds: An Expansion of the State of the Art pKa Model with Data from Three Industrial Partners

Conference: DDC
Software: ADMET Predictor®

In a unique collaboration between Simulations Plus and several industrial partners, we were able to develop a new version 11.0 of the previously published1 in silico pKa model, S+pKa, with considerably improved prediction accuracy.

Framework for Classifying Chemicals for Repeat Dose Toxicity using NAMs

Framework for Classifying Chemicals for Repeat Dose Toxicity using NAMs

Conference: EPAA NAM Designathon

Initially all chemicals are of High concern. Reassessment is based on accumulating evidence to potentially move chemicals to Medium or Low concern.

QSP in the Real World: Where Has Quantitative Systems Pharmacology (QSP) Been Used to Support Drug Development and With What Impact?

QSP in the Real World: Where Has Quantitative Systems Pharmacology (QSP) Been Used to Support Drug Development and With What Impact?

Authors: Shoda L

Quantitative systems pharmacology (QSP) is gaining acceptance and utilization in many drug development programs, but even those who appreciate its value may not fully recognize the extent to which it has already achieved impact and/or its range of potential applications.

Investigating the Potential Hepatotoxicity of ORM-48824 in a Quantitative Systems Toxicology Platform for Liver Safety, DILIsym®

Investigating the Potential Hepatotoxicity of ORM-48824 in a Quantitative Systems Toxicology Platform for Liver Safety, DILIsym®

Conference: SOT
Software: DILIsym®, MITOsym®
Division: DILIsym Services

ORM-48824 is a transient receptor potential Ankyrin-1 (TRPA1) antagonist and was initially being developed for patients with diabetic neuropathic pain...