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Functional ANnoTAtion based on embedding space SImilArity

Project description

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FANTASIA

Functional ANnoTAtion based on embedding space SImilArity

FANTASIA is an advanced pipeline for the automatic functional annotation of protein sequences using state-of-the-art protein language models. It integrates deep learning embeddings and in-memory similarity searches, retrieving reference vectors from a PostgreSQL database with pgvector, to associate Gene Ontology (GO) terms with proteins.

For full documentation, visit FANTASIA Documentation.

Key Features

  • ✅ Available Embedding Models
    Supports protein language models: ProtT5, ProstT5, and ESM2 for sequence representation.

  • 🔍 Redundancy Filtering
    Filters out homologous sequences using MMseqs2 in the lookup table, allowing controlled redundancy levels through an adjustable threshold, ensuring reliable benchmarking and evaluation.

  • 💾 Optimized Data Storage
    Embeddings are stored in HDF5 format for input sequences. The reference table, however, is hosted in a public relational PostgreSQL database using pgvector.

  • 🚀 Efficient Similarity Lookup
    Performs high-speed searches using in-memory computations. Reference vectors are retrieved from a PostgreSQL database with pgvector for comparison.

  • 🔬 Functional Annotation by Similarity
    Assigns Gene Ontology (GO) terms to proteins based on embedding space similarity, using pre-trained embeddings.

Pipeline Overview (Simplified)

  1. Embedding Generation
    Computes protein embeddings using deep learning models (ProtT5, ProstT5, and ESM2).

  2. GO Term Lookup
    Performs vector similarity searches using in-memory computations to assign Gene Ontology terms. Reference embeddings are retrieved from a PostgreSQL database with pgvector. Only experimental evidence codes are used for transfer.

Acknowledgments

FANTASIA is the result of a collaborative effort between Ana Rojas’ Lab (CBBIO) (Andalusian Center for Developmental Biology, CSIC) and Rosa Fernández’s Lab (Metazoa Phylogenomics Lab, Institute of Evolutionary Biology, CSIC-UPF). This project demonstrates the synergy between research teams with diverse expertise.

This version of FANTASIA builds upon previous work from:

  • Metazoa Phylogenomics Lab's FANTASIA
    The original implementation of FANTASIA for functional annotation.

  • bio_embeddings
    A state-of-the-art framework for generating protein sequence embeddings.

  • GoPredSim
    A similarity-based approach for Gene Ontology annotation.

  • protein-information-system
    Serves as the reference biological information system, providing a robust data model and curated datasets for protein structural and functional analysis.

We also extend our gratitude to LifeHUB-CSIC for inspiring this initiative and fostering innovation in computational biology.

Citing FANTASIA

If you use FANTASIA in your research, please cite the following publications:

  1. Martínez-Redondo, G. I., Barrios, I., Vázquez-Valls, M., Rojas, A. M., & Fernández, R. (2024).
    Illuminating the functional landscape of the dark proteome across the Animal Tree of Life.
    DOI: 10.1101/2024.02.28.582465

  2. Barrios-Núñez, I., Martínez-Redondo, G. I., Medina-Burgos, P., Cases, I., Fernández, R., & Rojas, A. M. (2024).
    Decoding proteome functional information in model organisms using protein language models.
    DOI: 10.1101/2024.02.14.580341


👥 Project Team

🔧 Technical Team

  • Francisco Miguel Pérez Canales: fmpercan@upo.es
    Author of the system’s engineering and technical implementation
  • Francisco J. Ruiz Mota: fraruimot@alum.us.es
    Junior developer

🧬 Scientific Team & Original Authors of FANTASIA v1


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