Analyzing and exploring Graph Attention Networks and protein-based language models for predicting Porhyromonas

Pradeep Kumar Yadalam1, Prabhu Manickam Natarajan2, Naresh Shetty3

  • 1Department of Periodontics, Saveetha Dental College, Saveetha Institute of Medical and Technical Sciences (SIMATS Deemed University), Chennai, India.

PubMed
Abstract

Insights

Large language models (LLMs) can predict protein sequences in P. gingivalis that cause antimicrobial resistance (AMR). This approach aids in developing targeted treatments to combat global AMR outbreaks.

Area of Science:

  • Computational biology
  • Genomics
  • Bioinformatics

Background:

  • Antimicrobial resistance (AMR) poses a global health threat, necessitating predictive methods for effective treatment.
  • Studying high-priority bacterial genomes, such as Porphyromonas gingivalis, aids in tracking resistance and preventing outbreaks.
  • Large language models (LLMs) are crucial for identifying specific genes, like multiresistant efflux genes in P. gingivalis, to combat AMR.

Purpose of the Study:

  • To explore the predictive capabilities of advanced computational models for identifying protein sequences associated with P. gingivalis treatment resistance.
  • To enhance strategies for preventing antimicrobial resistance through a deeper understanding of resistance mechanisms.

Main Methods:

  • Utilized multi-drug-resistant efflux protein sequences from P. gingivalis (UniProt ID: A0A0K2J2N6_PORGN).
  • Processed FASTA-formatted sequences using the DeepBIO framework, integrating LLMs with deep attention networks.
  • Ensured sequence quality and suitability for computational analysis through rigorous detection and assurance processes.

Main Results:

  • LSTM-attention, ProtBERT, and BERTGAT models demonstrated high sensitivity (0.9) and accuracy (89.5%, 88.5%, 90.5%, respectively) in identifying resistant P. gingivalis strains.
  • Model specificity scores were also high (0.89, 0.87, 0.90), indicating effective identification of non-resistant cases and minimizing false positives.
  • These findings underscore the models' efficacy in detecting multi-drug resistance in P. gingivalis.

Conclusions:

  • The LLM approach shows significant potential for clinical application in preventing global antimicrobial resistance.
  • This predictive capability can guide the development of more effective, targeted therapies against resistant genes.
  • Implementing this strategy could significantly contribute to the global effort to combat AMR and reduce resistance development.