QUEST™ / Quantum–AI Drug Discovery

Innovating the critical bottlenecks in drug development.

QUEST™ integrates molecular modelling, experimental evidence, artificial intelligence and quantum-derived representations to support better decisions from hit discovery through preclinical prediction.

01 / WHERE QUEST™ INTERVENES

QUEST™ addresses the decisive bottlenecks in drug development.

QUEST™ is QIC’s integrated Quantum–AI drug-discovery solution. Its three specialized modules support the development lifecycle from identifying experimentally credible hits to optimizing candidates and assessing preclinical ADMET and PK risk.

DRUG-DEVELOPMENT LIFECYCLEQUEST™ COVERAGE
01Target
02Hit Discovery
03Hit-to-Lead
04Lead Optimization
05Preclinical
06Clinical

Clinical development is shown as the downstream stage, not a current QUEST™ module.

Across the lifecycle

Limits of data-only AI. Sparse or biased datasets, unfamiliar chemical space and limited representation of molecular physics can reduce prediction reliability across the lifecycle.

02 / QUEST™ · MODULE 01

HIT DISCOVERY

Q-Dock

Q-Dock models both the target binding environment and candidate ligands, then compares their three-dimensional and electronic interaction patterns to predict binding affinity and the most plausible binding pose.

MODEL TRAINING & DATA FOUNDATION
Chemical DB + Quantum Modeling

Build learning representations from molecular and interaction data

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3D Image Match ML Model

Train the pattern-recognition and scoring model used in candidate matching

Q-Dock / STEP 01
Quest | QICTARGET BINDING SITEBinding pocketSpatial structureElectronicenvironment
Target binding-site analysis
Binding pocket
Spatial structure · Electronic environment
  • TARGET BINDING SITE
  • Binding pocket
  • Spatial structure
  • Electronic environment
STEP 01

Target binding-site analysis

Define the binding pocket and its spatial and electronic interaction environment.

03 / QUEST™ · MODULE 02

SCREENING & LEAD OPTIMIZATION

Supernatural AI

Supernatural AI identifies the molecular fragments that drive activity and uses them to iteratively design candidates with improved affinity, selectivity and drug-like properties.

Supernatural AI / STEP 01
Quest | QICFragment librariesAssay resultsVirtualfragmentationDEL screeningACTIVITY SIGNALSABCNoise filtering
Fragment libraries · Assay results · Virtual fragmentation · DEL screening data
Extract activity-related chemical signals
Candidate fragment seeds · Noise filtering
  • Fragment libraries
  • Assay results
  • Virtual fragmentation
  • DEL screening
  • ACTIVITY SIGNALS
  • Noise filtering
STEP 01

Extract activity-related chemical signals

Integrate fragment libraries, assay results, virtual fragmentation and DEL screening data to identify credible activity signals.

  • Candidate fragment seeds
  • Assay and DEL evidence
  • Noise filtering
IDENTIFYEVALUATEDESIGN

Each designed candidate is reassessed and refined until the target balance of activity and drug-like properties is achieved.

04 / QUEST™ · MODULE 03

PRECLINICAL PREDICTION

Virtual CRO

Virtual CRO translates molecular structure into ADMET and PK predictions, PK/PBPK analysis and concentration–time profiles, enabling earlier comparison and optimization of preclinical candidates.

Virtual CRO / STEP 01
Quest | QICDRUG STRUCTURE INPUTMolecular structureSMILES
Molecular structure or SMILES
Drug structure input
  • DRUG STRUCTURE INPUT
  • Molecular structure
  • SMILES
STEP 01

Drug structure input

Molecular structure or SMILES

05 / QUEST™ IN ACTIONREAL-WORLD DRUG DEVELOPMENT PROGRAM 01

ORAL PEPTIDE DRUG DISCOVERY

QUEST™ advances a proprietary α4β7 program from candidate discovery to oral drug development.

QIC applies QUEST™ to discover and optimize its proprietary α4β7-targeted peptide candidate, including binding affinity, target selectivity, drug-like properties, PK/PD and toxicity prediction. D&D Pharmatech applies and optimizes its ORALINK™ platform and conducts experimental efficacy evaluation to advance the asset toward an orally deliverable drug candidate.

TARGETIntegrin α4β7
INDICATIONInflammatory Bowel Disease
MODALITYOral Peptide Therapeutic
PROGRAM PERIODJul 2026 – Jun 2028
QIC · QUEST™ APPLICATIONONE ASSET · THREE SPECIALIZED MODULES
MODULE 01

Q-Dock

BINDING ASSESSMENTTarget siteHit priority

Models the α4β7 binding environment and evaluates target–candidate interactions.

  • Binding-site analysis
  • Affinity and binding-pose prediction
MODULE 02

Supernatural AI

CANDIDATE OPTIMIZATIONFragment designBalanced properties

Designs and optimizes peptide candidates for activity, selectivity and developability.

  • Candidate discovery and design
  • Multi-property optimization
MODULE 03

Virtual CRO

PRECLINICAL PREDICTIONADMET / PKDevelopment risk

Predicts PK/PD and toxicity to identify liabilities and guide candidate refinement.

  • PK/PD and exposure prediction
  • Toxicity and safety assessment

06 / QUEST™

Connect platform capability with real drug-development programs.

Explore QIC’s proprietary pipeline or discuss a discovery, optimization or preclinical prediction program.