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Record W4416298714 · doi:10.1093/nar/gkaf1265

Mapping drug mechanisms with ProteomicsDB: unified omics and cell sensitivity data at scale

2025· article· en· W4416298714 on OpenAlexaff
Mario Picciani, Armin Soleymaniniya, Julian Müller, Amirhossein Sakhteman, Konstantinos Tzanakis, Judith Bernett, Elias Kahl, Firas Hamood, Johannes Kersting, Mohsen Pourjam, Luís Augusto Eijy Nagai, Markus List, Bernhard Küster, Matthew The, Mathias Wilhelm

Bibliographic record

VenueNucleic Acids Research · 2025
Typearticle
Languageen
FieldChemistry
TopicAdvanced Proteomics Techniques and Applications
Canadian institutionsArtificial Intelligence in Medicine (Canada)
FundersHORIZON EUROPE Framework ProgrammeH2020 European Research CouncilDeutsche ForschungsgemeinschaftElitenetzwerk BayernEuropean Commission
KeywordsProteomicsProteomeTranscriptomeNormalization (sociology)Pipeline (software)PhenotypeBiomarkerSystems biologyOmicsPrecision medicine

Abstract

fetched live from OpenAlex

Proteomic and phenotypic cell sensitivity datasets are increasingly important for understanding chemoproteomics and the underlying drug mechanisms of action. Yet, integrating such heterogeneous datasets remains challenging due to inconsistent annotations, incompatible IDs, and variable data processing methods. Here, a major update to ProteomicsDB (https://www.proteomicsdb.org) is presented that combines over 1300 proteomic and 1000 transcriptomic profiles with phenotypic cell sensitivity data across >1500 human cancer cell lines and 1470 drugs. Harmonizing cell line and drug names and applying a standardized normalization and refitting pipeline for dose-response curves enables consistent, statistically robust analysis across studies. Three new graphical user interfaces support interactive exploration of cell sensitivity data, exploring the protein targets and dose-resolved changes in protein expression in the presence of a drug, and comparing the expression profiles of cell lines. With this update, ProteomicsDB is strengthening its future role as a central hub for proteomics and multi-omics, providing researchers with a unified framework to explore phenotypic cell sensitivity in combination with dose-resolved expression proteomics at the molecular level, supporting biomarker discovery, drug repurposing, and precision medicine applications.

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)0.009
metaresearch head score (Gemma)0.012
Version: metacan-v3-hybrid-931329e0061cValidation status: machine_predicted_unvalidated
Candidate categoriesnone
Consensus categoriesnone
DomainCandidate signal: none · Consensus signal: none
Study designCandidate signal: Not applicable · Consensus signal: Not applicable
GenreCandidate signal: Software · Consensus signal: none
Teacher disagreement score0.012
Threshold uncertainty score0.045

Distilled classifier scores by category (both heads)

CategoryCodexGemma
Metaresearch0.0090.012
Meta-epidemiology (narrow)0.0030.002
Meta-epidemiology (broad)0.0030.002
Bibliometrics0.0090.007
Science and technology studies0.0010.001
Scholarly communication0.0080.006
Open science0.0030.007
Research integrity0.0020.003
Insufficient payload (model declined to judge)0.0120.008

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 head0.037
GPT teacher head0.325
Teacher spread0.289 · 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 designNot applicable
Domainnot available
GenreSoftware

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

Citations1
Published2025
Admission routes1
Has abstractyes

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