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Record W4387531209 · doi:10.1101/2023.10.09.561503

ABTrans: A Transformer-based model for predicting interaction between anti-Aß antibodies and peptides

2023· preprint· en· W4387531209 on OpenAlexaff
Yuhong Su, Lingfeng Zhang, Yanjing Wang, Buyong Ma

Bibliographic record

VenuebioRxiv (Cold Spring Harbor Laboratory) · 2023
Typepreprint
Languageen
FieldMedicine
TopicMonoclonal and Polyclonal Antibodies Research
Canadian institutionsWilfrid Laurier UniversityUniversity of Ottawa
FundersNational Natural Science Foundation of China
KeywordsAntibodyPeptidePhage displayComputational biologyChemistryBinding sitePeptide libraryBiochemistryPeptide sequenceBiologyImmunologyGene

Abstract

fetched live from OpenAlex

Abstract Understanding the recognition of antibodies and Aβ peptide is crucial for the development of more effective therapeutic agents. Here we studied the interaction between anti-Aβ antibodies and different peptides by building a deep learning model, using the dodecapeptide sequences elucidated from phage display and known anti-Aβ antibody sequences collected from public sources. Our multi-classification model, ABTrans was trained to determine the four levels of binding ability between anti-Aβ antibody and dodecapeptide: not binding, weak binding, medium binding, and strong binding. The accuracy of our model reached 0.8278. Using the ABTrans, we examined the cross-reaction of anti-Aβ antibodies with other human amyloidogenic proteins, and we found that Aducanumab and Donanemab have the least cross-reactions with other human amyloidogenic proteins. We also systematically screened all human proteins interaction with eleven selected anti-Aβ antibodies to identify possible peptide fragments that could be an off-target candidate. Key Points ABTrans is a Transformer-based model that was developed for the first time to predict the interaction between anti-Aß antibodies and peptides. ABTrans was trained using a dataset with 1.5 million peptides and 110 anti-Aβ antibodies. ABTrans achieved an accuracy of 0.8278 and is capable of determining the four levels of binding ability between antibody and Aß: not binding, weak binding, medium binding, and strong binding. ABTrans has potential applications in predicting off-target and cross-reactivity effects of antibodies and in designing new anti-Aß antibodies.

Fetched live from OpenAlex and de-inverted. Abstracts are not stored in this database: the inverted indexes are 8.6 GB of the frame’s 9.3 GB of text, and the host has 13 GB free.

How this classification was reachedexpand

Full frame machine prediction

Teacher imitation

Not calibrated prevalence, not ground truth. Human validation pending. The Gemma side is a direct model label for every work in the frame, read from the title-only record. The Codex side is a classifier learned from the 10,348 direct Codex labels and calibrated to design-weighted sample rates; fields without enough sample support carry no Codex call. Candidate is the union of the two sides; consensus is their intersection. These outputs are machine_predicted_unvalidated and are not human labels.

metaresearch head score (Codex)0.001
metaresearch head score (Gemma)0.001
Version: metacan-v3-hybrid-931329e0061cValidation status: machine_predicted_unvalidated
Candidate categoriesnone
Consensus categoriesnone
DomainCandidate signal: none · Consensus signal: none
Study designCandidate signal: Simulation or modeling · Consensus signal: Simulation or modeling
GenreCandidate signal: Empirical · Consensus signal: Empirical
Teacher disagreement score0.015
Threshold uncertainty score0.030

Distilled classifier scores by category (both heads)

CategoryCodexGemma
Metaresearch0.0010.001
Meta-epidemiology (narrow)0.0010.000
Meta-epidemiology (broad)0.0010.001
Bibliometrics0.0010.000
Science and technology studies0.0000.000
Scholarly communication0.0010.001
Open science0.0010.000
Research integrity0.0010.001
Insufficient payload (model declined to judge)0.0020.001

Machine scores (provisional)

The two teacher heads of the student model, read on this work. A score orders the frame for review; it never asserts a category, and the validation status ships verbatim with every row.

Baseline scores from an immature model (maturity gate not passed, 7 training rounds). Scores rank; they never assert a category.

Opus teacher head0.065
GPT teacher head0.315
Teacher spread0.250 · how far apart the two teachers sit on this one work
Validation statusscore_only:v0-immature-baseline · verbatim from the scoring run: score_only means the number may rank works, and no category label ships from it

Classification

machine, unvalidated

Machine predicted; a candidate call from one source (direct Gemma or distilled Codex), not a consensus.

The models applied no category: nothing in the taxonomy fit this work.
Study designSimulation or modeling
Domainnot available
GenreEmpirical

How this classification was reached, model by model and score by score, is at the end of the page under "How this classification was reached".

Quick stats

Citations0
Published2023
Admission routes1
Has abstractyes

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