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Task

RNA-small-molecule binding-site prediction

RNA small-molecule binding-site prediction uses independent RNA–ligand test collections with explicit redundancy filtering.

SourcesRNA language model and graph attention network for RNA and small molecule binding sites prediction · Methods §§2.1, 2.7; cached text lines 13–15, 57–58

1 evaluation · 1 metric row

At a glance

Inputs, training, access and other details

Explanatory profile: limited source coverage · Automated source review, 2026-09-16. Review applies to the cited claims; unresolved fields are listed below. Numerical results retain their own review status.

Data, procedure and scoring
PropertyDescription and evidence
DatasetsCombined RNAglib/RNAsite training data; T18, T3 and newly curated T10 tests.
SourcesRNA language model and graph attention network for RNA and small molecule binding sites prediction · Methods §§2.1, 2.7; cached text lines 13–15, 57–58
SplitsThe named test collections are held separate; T10 uses later PDB entries.
SourcesRNA language model and graph attention network for RNA and small molecule binding sites prediction · Methods §§2.1, 2.7; cached text lines 13–15, 57–58
MetricsPrecision, recall, MCC and ROC-AUC.
SourcesRNA language model and graph attention network for RNA and small molecule binding sites prediction · Methods §§2.1, 2.7; cached text lines 13–15, 57–58
BaselinesTraining data align with MultiModRLBP for comparison.
SourcesRNA language model and graph attention network for RNA and small molecule binding sites prediction · Methods §§2.1, 2.7; cached text lines 13–15, 57–58
Leakage controlsT3 removes high-similarity RNAs relative to training; T10 is clustered and filtered against training RNA.
SourcesRNA language model and graph attention network for RNA and small molecule binding sites prediction · Methods §§2.1, 2.7; cached text lines 13–15, 57–58
UncertaintyThe paper reports t-tests comparing metrics; the exact replication unit should be confirmed before interpreting them as independent-sample uncertainty.
SourcesRNA language model and graph attention network for RNA and small molecule binding sites prediction · Methods §§2.1, 2.7; cached text lines 13–15, 57–58
Entity typePaper-specific computational evaluation protocol.
SourcesRNA language model and graph attention network for RNA and small molecule binding sites prediction · Methods §§2.1, 2.7; cached text lines 13–15, 57–58
OrganismsRNAglib/RNAsite-derived RNA chains and PDB-derived test sets define this benchmark. Section 2.1 reports chain and ligand membership criteria but not a taxonomic inventory; synthetic aptamer examples cannot be assigned an organism from the surrounding disease discussion. · Not reported in inspected sources
SourcesRNA language model and graph attention network for RNA and small molecule binding sites prediction · §2.1 Benchmark datasets; RNA–ligand test examples
AssaysRNA–small-molecule binding-site annotations.
SourcesRNA language model and graph attention network for RNA and small molecule binding sites prediction · Methods §§2.1, 2.7; cached text lines 13–15, 57–58
Allowed inputsRNA representations for site prediction.
SourcesRNA language model and graph attention network for RNA and small molecule binding sites prediction · Methods §§2.1, 2.7; cached text lines 13–15, 57–58
AdaptationSupervised fitting on the combined training data; later PDB entries supply one held-out test.
SourcesRNA language model and graph attention network for RNA and small molecule binding sites prediction · Methods §§2.1, 2.7; cached text lines 13–15, 57–58

How it works

How it worksComputational evaluation flow
Computational evaluation flow1. Input: RNA representations for site prediction.. Then: 2. Evaluation: Supervised fitting on the combined training data; later PDB entries supply one held-out test.. Then: 3. Readout: Precision, recall, MCC and ROC-AUC.Computational evaluation flow1. Input: RNA representations for site prediction.. Then: 2. Evaluation: Supervised fitting on the combined training data; later PDB entries supply one held-out test.. Then: 3. Readout: Precision, recall, MCC and ROC-AUC.Computational evaluation flow1. Input: RNA representations for site prediction.. Then: 2. Evaluation: Supervised fitting on the combined training data; later PDB entries supply one held-out test.. Then: 3. Readout: Precision, recall, MCC and ROC-AUC.

Conceptual summary of the cited evaluation; exact task configuration and source version remain part of the protocol.

SourcesRNA language model and graph attention network for RNA and small molecule binding sites prediction · Methods §§2.1, 2.7; cached text lines 13–15, 57–58
Evaluation methodology

Combined RNAglib/RNAsite training data; T18, T3 and newly curated T10 tests. The named test collections are held separate; T10 uses later PDB entries. Precision, recall, MCC and ROC-AUC. Training data align with MultiModRLBP for comparison. T3 removes high-similarity RNAs relative to training; T10 is clustered and filtered against training RNA. The paper reports t-tests comparing metrics; the exact replication unit should be confirmed before interpreting them as independent-sample uncertainty.

SourcesRNA language model and graph attention network for RNA and small molecule binding sites prediction · Methods §§2.1, 2.7; cached text lines 13–15, 57–58

Recorded evaluations

Each evaluation records what was tested and under which conditions.

Tested entities and results

Release 2026-09-17-d277315f7d76 · 1 evaluation · 1 metric row. Different protocols are not a single leaderboard.

Results grouped by the exact reported evaluation
Metric and findingCoverage and uncertaintyEvidence
RLsite: RNA-small-molecule binding-site prediction

RNA language-model plus graph-attention classifier

Author-reported evaluation · Evaluation metadata: needs review

0.828 AUC

Unit: fraction · Direction: unknown

Uncertainty: not reported in legacy extract

Scored: Not reported · Eligible: Not reported

source checkedRNA language model and graph attention network for RNA and small molecule binding sites prediction · Table 1, RLsite row, T18 AUC column

Source checking is not independent reproduction.

Papers and result coverage

Last literature check: 2026-09-17. Primary-paper discovery and source inspection. Source-checked results are not independently reproduced experiments.

Paper or primary resourceVersionReference
RNA language model and graph attention network for RNA and small molecule binding sites predictionjournal full text in PMCRead source
DOI: 10.1093/bioinformatics/btaf447

What is still missing

  • Most baseline values are copied from original publications; RNABind is a web-server run.
  • T18/T3/T10 are separate protocols and cannot be pooled as one model score.
  • Unavailable RNet AUC is a dash, not zero.
Search and extraction details

primary comparison table screened

Searches

  • "PMC12417085"

Evidence locations

  • Tables 1–3 footnotes
  • Section 2.1 Benchmark datasets

Strengths and limitations

Strengths and considerations

No source-reviewed explanatory claims are recorded here yet.

Profile review details

Relevant full-paper computational evaluation sections, tables/captions and cited supplementary task passages were reviewed. Reporting omissions are scoped to the inspected sources. Original numerical results are unchanged.

Stable record: reported-task-b00a636d1ed8d9

Evidence table

Inspect claims, sources and review details

Trace each statement to its source and review. A context-only reference supports the record generally; it does not verify an individual field. Source checking does not reproduce an experiment.

One row per statement and cited source. Multiple citations are not independent evaluations. Shared locators are labelled explicitly.

17 evidence rows matching the loaded filters

Claims, original sources and review scope · Release 2026-09-17-d277315f7d76
Property and statementOriginal source and locationReview and provenance
Diagram caption

Conceptual summary of the cited evaluation; exact task configuration and source version remain part of the protocol.

Individual claims
RNA language model and graph attention network for RNA and small molecule binding sites prediction

Original source ↗

Methods §§2.1, 2.7; cached text lines 13–15, 57–58

Version: journal full text in PMC
Retrieved: 2026-09-16T10:38:57.558222+00:00

source checked

automated source review · 2026-09-16

Audit details

Relevant full-paper computational evaluation sections, tables/captions and cited supplementary task passages were reviewed. Reporting omissions are scoped to the inspected sources. Original numerical results are unchanged.

Field: attributes.profile.diagram.caption

Source artifact SHA-256: a50f344e253162ae43f51d7120cfb35a1d0f6114fd8176d760aceb6d05fd95bd

Hash scope: Hash scope not separately documented; inspect source record

Inspected artifact

Diagram steps

["Input: RNA representations for site prediction.","Evaluation: Supervised fitting on the combined training data; later PDB entries supply one held-out test.","Readout: Precision, recall, MCC and ROC-AUC."]

Individual claims
RNA language model and graph attention network for RNA and small molecule binding sites prediction

Original source ↗

Methods §§2.1, 2.7; cached text lines 13–15, 57–58

Version: journal full text in PMC
Retrieved: 2026-09-16T10:38:57.558222+00:00

source checked

automated source review · 2026-09-16

Audit details

Relevant full-paper computational evaluation sections, tables/captions and cited supplementary task passages were reviewed. Reporting omissions are scoped to the inspected sources. Original numerical results are unchanged.

Field: attributes.profile.diagram.steps

Source artifact SHA-256: a50f344e253162ae43f51d7120cfb35a1d0f6114fd8176d760aceb6d05fd95bd

Hash scope: Hash scope not separately documented; inspect source record

Inspected artifact

Diagram title

Computational evaluation flow

Individual claims
RNA language model and graph attention network for RNA and small molecule binding sites prediction

Original source ↗

Methods §§2.1, 2.7; cached text lines 13–15, 57–58

Version: journal full text in PMC
Retrieved: 2026-09-16T10:38:57.558222+00:00

source checked

automated source review · 2026-09-16

Audit details

Relevant full-paper computational evaluation sections, tables/captions and cited supplementary task passages were reviewed. Reporting omissions are scoped to the inspected sources. Original numerical results are unchanged.

Field: attributes.profile.diagram.title

Source artifact SHA-256: a50f344e253162ae43f51d7120cfb35a1d0f6114fd8176d760aceb6d05fd95bd

Hash scope: Hash scope not separately documented; inspect source record

Inspected artifact

Datasets

Combined RNAglib/RNAsite training data; T18, T3 and newly curated T10 tests.

Individual claims
RNA language model and graph attention network for RNA and small molecule binding sites prediction

Original source ↗

Methods §§2.1, 2.7; cached text lines 13–15, 57–58

Version: journal full text in PMC
Retrieved: 2026-09-16T10:38:57.558222+00:00

source checked

automated source review · 2026-09-16

Audit details

Relevant full-paper computational evaluation sections, tables/captions and cited supplementary task passages were reviewed. Reporting omissions are scoped to the inspected sources. Original numerical results are unchanged.

Field: attributes.profile.facts.0.value

Source artifact SHA-256: a50f344e253162ae43f51d7120cfb35a1d0f6114fd8176d760aceb6d05fd95bd

Hash scope: Hash scope not separately documented; inspect source record

Inspected artifact

Splits

The named test collections are held separate; T10 uses later PDB entries.

Individual claims
RNA language model and graph attention network for RNA and small molecule binding sites prediction

Original source ↗

Methods §§2.1, 2.7; cached text lines 13–15, 57–58

Version: journal full text in PMC
Retrieved: 2026-09-16T10:38:57.558222+00:00

source checked

automated source review · 2026-09-16

Audit details

Relevant full-paper computational evaluation sections, tables/captions and cited supplementary task passages were reviewed. Reporting omissions are scoped to the inspected sources. Original numerical results are unchanged.

Field: attributes.profile.facts.1.value

Source artifact SHA-256: a50f344e253162ae43f51d7120cfb35a1d0f6114fd8176d760aceb6d05fd95bd

Hash scope: Hash scope not separately documented; inspect source record

Inspected artifact

Adaptation

Supervised fitting on the combined training data; later PDB entries supply one held-out test.

Individual claims
RNA language model and graph attention network for RNA and small molecule binding sites prediction

Original source ↗

Methods §§2.1, 2.7; cached text lines 13–15, 57–58

Version: journal full text in PMC
Retrieved: 2026-09-16T10:38:57.558222+00:00

source checked

automated source review · 2026-09-16

Audit details

Relevant full-paper computational evaluation sections, tables/captions and cited supplementary task passages were reviewed. Reporting omissions are scoped to the inspected sources. Original numerical results are unchanged.

Field: attributes.profile.facts.10.value

Source artifact SHA-256: a50f344e253162ae43f51d7120cfb35a1d0f6114fd8176d760aceb6d05fd95bd

Hash scope: Hash scope not separately documented; inspect source record

Inspected artifact

Metrics

Precision, recall, MCC and ROC-AUC.

Individual claims
RNA language model and graph attention network for RNA and small molecule binding sites prediction

Original source ↗

Methods §§2.1, 2.7; cached text lines 13–15, 57–58

Version: journal full text in PMC
Retrieved: 2026-09-16T10:38:57.558222+00:00

source checked

automated source review · 2026-09-16

Audit details

Relevant full-paper computational evaluation sections, tables/captions and cited supplementary task passages were reviewed. Reporting omissions are scoped to the inspected sources. Original numerical results are unchanged.

Field: attributes.profile.facts.2.value

Source artifact SHA-256: a50f344e253162ae43f51d7120cfb35a1d0f6114fd8176d760aceb6d05fd95bd

Hash scope: Hash scope not separately documented; inspect source record

Inspected artifact

Baselines

Training data align with MultiModRLBP for comparison.

Individual claims
RNA language model and graph attention network for RNA and small molecule binding sites prediction

Original source ↗

Methods §§2.1, 2.7; cached text lines 13–15, 57–58

Version: journal full text in PMC
Retrieved: 2026-09-16T10:38:57.558222+00:00

source checked

automated source review · 2026-09-16

Audit details

Relevant full-paper computational evaluation sections, tables/captions and cited supplementary task passages were reviewed. Reporting omissions are scoped to the inspected sources. Original numerical results are unchanged.

Field: attributes.profile.facts.3.value

Source artifact SHA-256: a50f344e253162ae43f51d7120cfb35a1d0f6114fd8176d760aceb6d05fd95bd

Hash scope: Hash scope not separately documented; inspect source record

Inspected artifact

Leakage controls

T3 removes high-similarity RNAs relative to training; T10 is clustered and filtered against training RNA.

Individual claims
RNA language model and graph attention network for RNA and small molecule binding sites prediction

Original source ↗

Methods §§2.1, 2.7; cached text lines 13–15, 57–58

Version: journal full text in PMC
Retrieved: 2026-09-16T10:38:57.558222+00:00

source checked

automated source review · 2026-09-16

Audit details

Relevant full-paper computational evaluation sections, tables/captions and cited supplementary task passages were reviewed. Reporting omissions are scoped to the inspected sources. Original numerical results are unchanged.

Field: attributes.profile.facts.4.value

Source artifact SHA-256: a50f344e253162ae43f51d7120cfb35a1d0f6114fd8176d760aceb6d05fd95bd

Hash scope: Hash scope not separately documented; inspect source record

Inspected artifact

Uncertainty

The paper reports t-tests comparing metrics; the exact replication unit should be confirmed before interpreting them as independent-sample uncertainty.

Individual claims
RNA language model and graph attention network for RNA and small molecule binding sites prediction

Original source ↗

Methods §§2.1, 2.7; cached text lines 13–15, 57–58

Version: journal full text in PMC
Retrieved: 2026-09-16T10:38:57.558222+00:00

source checked

automated source review · 2026-09-16

Audit details

Relevant full-paper computational evaluation sections, tables/captions and cited supplementary task passages were reviewed. Reporting omissions are scoped to the inspected sources. Original numerical results are unchanged.

Field: attributes.profile.facts.5.value

Source artifact SHA-256: a50f344e253162ae43f51d7120cfb35a1d0f6114fd8176d760aceb6d05fd95bd

Hash scope: Hash scope not separately documented; inspect source record

Inspected artifact

Sources and history

Release 2026-09-17-d277315f7d76 · Record review: needs review

2 source records and release historyDownload this release
Technical metadata and extraction receipts

Stable ID: reported-task-b00a636d1ed8d9

areas
rna-transcriptomes
tasks
RNA-small-molecule binding-site prediction
entity level
task
version
Not reported
task
RNA-small-molecule binding-site prediction
scope note
Paper-specific evaluation task; protocol completeness requires further extraction.
benchmark research
review date: 2026-09-17; status: primary_comparison_table_screened; primary sources: expansion-p3-rlsite-rna-binding-2025; inspected locators: Tables 1–3 footnotes; Section 2.1 Benchmark datasets; searched queries: "PMC12417085"; gaps: Most baseline values are copied from original publications; RNABind is a web-server run.; T18/T3/T10 are separate protocols and cannot be pooled as one model score.; Unavailable RNet AUC is a dash, not zero.; claim scope: Primary-paper discovery and source inspection. Source-checked results are not independently reproduced experiments.
historical missing metadata
protocol version: not_reported_in_legacy_extract
metadata review scope
historical_missing_metadata preserves the original discovery state. Current descriptive evidence and missingness are recorded in profile.facts; numerical-result review is separate.
legacy kinds
benchmark
entity classification
review date: 2026-09-17; rationale: This source-scoped record identifies the biological prediction task and holds its paper context. Preserve the existing task identity; exact split, model adaptation and scoring remain in linked evaluations or separate protocol records.; source ids: rlsite-rna-binding-2025; source locator: Methods §§2.1, 2.7; cached text lines 13–15, 57–58; ambiguities: A paper- or suite-specific task may constrain some inputs or metrics; that alone does not make it interchangeable with a complete versioned protocol. No protocol equivalence is inferred.; Some legacy profile Entity type facts use the generic phrase computational evaluation protocol. That boilerplate is not sufficient to establish a single fixed protocol identity or to merge this task with another protocol record.
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