• Home
  • /
  • AI-Guided Targeted Protein Degradation: PROTACs, Molecular Glues & Degrader Design
Biotechnology · Moderate · Live online

AI-Guided Targeted Protein Degradation: PROTACs, Molecular Glues & Degrader Design

From Protein Inhibition to Protein Destruction — Design, Model and Prioritise Next-Generation Degraders with AI.

21–23 Sep 20265:30 PM IST3 Days (1.5 Hours Per Day)Certificate
The live sessions are over · get the full recording

About This Course

This three-day hands-on workshop introduces participants to Targeted Protein Degradation (TPD), an emerging therapeutic strategy that removes disease-associated proteins rather than simply inhibiting them. Participants will explore PROTACs, molecular glues, E3-ligase biology, ternary-complex formation, linker design and AI-assisted degrader prediction through guided computational activities using structural biology, cheminformatics and machine-learning tools.

Aim

To provide participants with practical knowledge of targeted protein degradation, PROTAC and molecular-glue design, ternary-complex modelling, molecular-property analysis and AI-assisted degrader prioritisation for modern drug-discovery and therapeutic-research applications.

Workshop Objectives

  • Understand the biological principles of targeted protein degradation and event-driven pharmacology.
  • Explore the ubiquitin–proteasome system and the role of E3 ligases in protein degradation.
  • Understand PROTAC architecture, including target ligands, linkers and E3-ligase recruiters.
  • Identify disease-relevant protein targets and suitable ligands for degrader development.
  • Analyse target–PROTAC–E3 ternary-complex structures.
  • Evaluate linker and molecular properties influencing degrader performance.
  • Understand molecular-glue degraders and induced-proximity mechanisms.
  • Generate molecular descriptors and fingerprints for degrader molecules.
  • Build machine-learning models for degrader-activity prediction.
  • Apply explainable AI and multi-parameter ranking for candidate prioritisation.
Next: Day-by-day →

Workshop Structure

📅 Day 1: Targeted Protein Degradation & PROTAC Design

Focus: Understanding TPD biology and building a computational PROTAC design strategy.

Topics Covered

  • Event-driven protein degradation and the ubiquitin–proteasome system
  • Role of E3 ligases, including CRBN and VHL
  • PROTAC architecture: warhead, linker and E3-ligase recruiter
  • Target selection, ligand identification and E3-ligase pairing
  • Introduction to molecular glues and other induced-proximity modalities

🛠️ Hands-on Activities

  • Select a disease-relevant protein target
  • Retrieve target and E3-ligase structures
  • Identify suitable ligands and recruiter molecules
  • Build a preliminary PROTAC design strategy

🧰 Tools Covered:

UniProt, RCSB PDB, AlphaFold DB, PubChem, ChEMBL, PROTAC databases, RDKit


📅 Day 2: Ternary Complex Modeling, Linker Design & Molecular Glues

Focus: Evaluating structural features that influence productive protein degradation.

Topics Covered

  • Target–PROTAC–E3 ternary-complex formation
  • Ternary-complex geometry and cooperativity
  • Linker length, flexibility, polarity and attachment points
  • PROTAC physicochemical and beyond-Rule-of-Five properties
  • Molecular glue degraders and neosubstrate recruitment

🛠️ Hands-on Activities

  • Analyse a representative ternary complex
  • Compare alternative linker designs
  • Calculate key molecular properties
  • Visualise and prioritise degrader architectures

🧰 Tools Covered:

RCSB PDB, AlphaFold DB, RDKit, PyMOL, Py3Dmol, Python, PROTAC databases


📅 Day 3: AI-Based Degrader Prediction & Candidate Prioritisation

Focus: Using machine learning and explainable AI to predict degrader performance and rank candidates.

Topics Covered

  • Key TPD metrics: DC₅₀, Dmax, potency and selectivity
  • Degrader descriptors and molecular fingerprints
  • Machine-learning models for activity prediction
  • Explainable AI for identifying important molecular features
  • Multi-parameter ranking using activity, structure and physicochemical properties
  • Computational limitations and experimental-validation considerations
  • 🛠️ Hands-on Activities
  • Prepare a degrader activity dataset
  • Generate RDKit descriptors and fingerprints
  • Train and evaluate an ML prediction model
  • Apply SHAP analysis
  • Rank degrader candidates using multiple criteria

🧰 Tools Covered:

RDKit, Python, Pandas, Scikit-learn, XGBoost, SHAP, PyMOL, Py3Dmol

Who Should Enrol?

  • Graduate and Postgraduate Students from Biotechnology, Bioinformatics, Biochemistry, Molecular Biology, Pharmacy, Pharmaceutical Sciences, Chemistry, Biomedical Sciences, Life Sciences, and related disciplines
  • Ph.D. Scholars and Researchers working in drug discovery, cancer biology, protein science, medicinal chemistry, molecular pharmacology, structural biology, chemical biology, or computational biology
  • Academicians and Faculty Members interested in targeted protein degradation, PROTACs, molecular glues, AI-enabled drug discovery, and computational therapeutic research
  • Industry Professionals from pharmaceutical, biotechnology, CRO, medicinal chemistry, computational chemistry, bioinformatics, and AI/ML-driven drug-discovery teams
Next: Dates →

Important Dates

Registration Ends

September 21, 2026
IST 4: 30 PM

Workshop Dates

September 21, 2026 – September 23, 2026
IST 5:30 PM

Workshop Outcomes

  • Explain how targeted protein degradation differs from conventional drug inhibition.
  • Identify suitable disease targets and E3 ligases for degrader development.
  • Design the basic architecture of a PROTAC molecule.
  • Interpret target–PROTAC–E3 ternary complexes.
  • Evaluate linker and molecular properties affecting degrader behaviour.
  • Understand the mechanism of molecular-glue degraders.
  • Generate molecular descriptors and fingerprints for degrader molecules.
  • Build and evaluate an ML model for degrader-activity prediction.
  • Use explainable AI to identify important molecular features.
  • Prioritise degrader candidates using structural, molecular and predicted activity information.
  • Prepare a computationally supported degrader-design strategy for further research or experimental validation.
Next: Fees →

Recording fee

Participants in India

₹2,499

Participants outside India

$50

  • All session recordings
  • Study material
  • Certificate after completion
  • 1-year access

Get the recording

The live sessions of this workshop are over, so the live fees no longer apply.

Next: FAQ →

Frequently asked questions

Will I get the recording?

Yes. Paid participants get the session recordings and study material in their NanoSchool dashboard (My registrations → Recorded Lectures / Study Material).

What if I miss a live session?

Watch the recording in your dashboard and send your questions to the mentor through the support desk.

Do I get a certificate?

Yes, an e-certificate of participation after the workshop, with a QR code anyone can verify and an "Add to LinkedIn" button.

Which fee category applies to me?

Choose the category that matches your current role: Student, Ph.D. Scholar / Researcher, Academician / Faculty or Industry Professional.

How can I pay?

By card, UPI or PayPal on the payment page; international bank transfer is also available there.

What is the refund policy?

See our Returns, Refunds & Cancellation policy: Returns, Refunds & Cancellation policy

Need Help?

We’re here for you!


(+91) 120-4781-217
WhatsApp +91 99581 61117

Registration open

More upcoming workshops

Live, mentor-led and certified. Dates and times in IST.

See all workshops
FREEDOM TO LEARN • 10% OFF All Courses & Workshops • Use Code: NANOINDIA10 • ⏳ Offer Ends In: Loading... • Learn Today. Lead Tomorrow. • Explore Programs →
FREEDOM TO LEARN • 10% OFF All Courses & Workshops • Use Code: NANOINDIA10 • ⏳ Offer Ends In: Loading... • Learn Today. Lead Tomorrow. • Explore Programs →
Support