rewire.itbenchmarks
Dataset

COACH420, trained on CHEN11

Dataset and cohort used in the cited comparison. Dataset population counts do not establish successful prediction coverage.

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Release 2026-09-29-06401fd5b220 · Evidence verified: Not verified

Evidence incomplete

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Verified: Not verified

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Verified: Not verified

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Verified: Not verified

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Verified: Not verified

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Read reviewed discrepancy investigations

Evaluation results

3 evaluations · 12 results. Different protocols are not a single leaderboard.

Filter evaluations

Applied filters: All linked evaluations

Exact evaluated configurations and original reported results
Tested configurationProtocol and datasetFindingEvidence and details
Configuration: CLAPE-SMBProtocol: COACH420, trained on CHEN11 (protein-small molecule binding-site prediction)
Dataset: COACH420, trained on CHEN11
0.876 ± 0.002 AUROC
unitless · higher

Uncertainty: printed: 0.002; value: 0.002; type: not explicitly identified in inspected table or caption

Coverage: Not reported scored / Not reported eligible

Author-reported evaluation · Source checked
Methods, coverage and source

CLAPE-SMB: COACH420, trained on CHEN11

Residue-level small-molecule binding-site classification. CHEN11 training, COACH420 test.

Aggregation: Not reported

Protein-small molecule binding site prediction based on a pre-trained protein language model with contrastive learning · Table 2 (Tab2), row 4 CLAPE-SMB, column 5: COACH420, trained on CHEN11 AUROC
Configuration: P2RankProtocol: COACH420, trained on CHEN11 (protein-small molecule binding-site prediction)
Dataset: COACH420, trained on CHEN11
0.079 Precision
unitless · higher

Uncertainty: Not reported

Coverage: Not reported scored / Not reported eligible

Result quoted from another source · Source checked
Methods, coverage and source

P2Rank: COACH420, trained on CHEN11

Residue-level small-molecule binding-site classification. CHEN11 training, COACH420 test.

Aggregation: Not reported

Protein-small molecule binding site prediction based on a pre-trained protein language model with contrastive learning · Table 2 (Tab2), row 2 P2Rank, column 3: COACH420, trained on CHEN11 Precision
Configuration: P2RankProtocol: COACH420, trained on CHEN11 (protein-small molecule binding-site prediction)
Dataset: COACH420, trained on CHEN11
N/A AUROC
unitless · higher

Uncertainty: Not reported

Coverage: Not reported scored / Not reported eligible

Result quoted from another source · Source checked
Methods, coverage and source

P2Rank: COACH420, trained on CHEN11

Residue-level small-molecule binding-site classification. CHEN11 training, COACH420 test.

Aggregation: Not reported

Protein-small molecule binding site prediction based on a pre-trained protein language model with contrastive learning · Table 2 (Tab2), row 2 P2Rank, column 5: COACH420, trained on CHEN11 AUROC
Configuration: GraphBindProtocol: COACH420, trained on CHEN11 (protein-small molecule binding-site prediction)
Dataset: COACH420, trained on CHEN11
0.477 Recall
unitless · higher

Uncertainty: Not reported

Coverage: Not reported scored / Not reported eligible

Result quoted from another source · Source checked
Methods, coverage and source

GraphBind: COACH420, trained on CHEN11

Residue-level small-molecule binding-site classification. CHEN11 training, COACH420 test.

Aggregation: Not reported

Protein-small molecule binding site prediction based on a pre-trained protein language model with contrastive learning · Table 2 (Tab2), row 3 GraphBind, column 2: COACH420, trained on CHEN11 Recall
Configuration: GraphBindProtocol: COACH420, trained on CHEN11 (protein-small molecule binding-site prediction)
Dataset: COACH420, trained on CHEN11
0.889 AUROC
unitless · higher

Uncertainty: Not reported

Coverage: Not reported scored / Not reported eligible

Result quoted from another source · Source checked
Methods, coverage and source

GraphBind: COACH420, trained on CHEN11

Residue-level small-molecule binding-site classification. CHEN11 training, COACH420 test.

Aggregation: Not reported

Protein-small molecule binding site prediction based on a pre-trained protein language model with contrastive learning · Table 2 (Tab2), row 3 GraphBind, column 5: COACH420, trained on CHEN11 AUROC
Configuration: GraphBindProtocol: COACH420, trained on CHEN11 (protein-small molecule binding-site prediction)
Dataset: COACH420, trained on CHEN11
0.303 MCC
unitless · higher

Uncertainty: Not reported

Coverage: Not reported scored / Not reported eligible

Result quoted from another source · Source checked
Methods, coverage and source

GraphBind: COACH420, trained on CHEN11

Residue-level small-molecule binding-site classification. CHEN11 training, COACH420 test.

Aggregation: Not reported

Protein-small molecule binding site prediction based on a pre-trained protein language model with contrastive learning · Table 2 (Tab2), row 3 GraphBind, column 4: COACH420, trained on CHEN11 MCC
Configuration: CLAPE-SMBProtocol: COACH420, trained on CHEN11 (protein-small molecule binding-site prediction)
Dataset: COACH420, trained on CHEN11
0.395 ± 0.066 Recall
unitless · higher

Uncertainty: printed: 0.066; value: 0.066; type: not explicitly identified in inspected table or caption

Coverage: Not reported scored / Not reported eligible

Author-reported evaluation · Source checked
Methods, coverage and source

CLAPE-SMB: COACH420, trained on CHEN11

Residue-level small-molecule binding-site classification. CHEN11 training, COACH420 test.

Aggregation: Not reported

Protein-small molecule binding site prediction based on a pre-trained protein language model with contrastive learning · Table 2 (Tab2), row 4 CLAPE-SMB, column 2: COACH420, trained on CHEN11 Recall
Configuration: GraphBindProtocol: COACH420, trained on CHEN11 (protein-small molecule binding-site prediction)
Dataset: COACH420, trained on CHEN11
0.223 Precision
unitless · higher

Uncertainty: Not reported

Coverage: Not reported scored / Not reported eligible

Result quoted from another source · Source checked
Methods, coverage and source

GraphBind: COACH420, trained on CHEN11

Residue-level small-molecule binding-site classification. CHEN11 training, COACH420 test.

Aggregation: Not reported

Protein-small molecule binding site prediction based on a pre-trained protein language model with contrastive learning · Table 2 (Tab2), row 3 GraphBind, column 3: COACH420, trained on CHEN11 Precision
Configuration: CLAPE-SMBProtocol: COACH420, trained on CHEN11 (protein-small molecule binding-site prediction)
Dataset: COACH420, trained on CHEN11
0.371 ± 0.009 MCC
unitless · higher

Uncertainty: printed: 0.009; value: 0.009; type: not explicitly identified in inspected table or caption

Coverage: Not reported scored / Not reported eligible

Author-reported evaluation · Source checked
Methods, coverage and source

CLAPE-SMB: COACH420, trained on CHEN11

Residue-level small-molecule binding-site classification. CHEN11 training, COACH420 test.

Aggregation: Not reported

Protein-small molecule binding site prediction based on a pre-trained protein language model with contrastive learning · Table 2 (Tab2), row 4 CLAPE-SMB, column 4: COACH420, trained on CHEN11 MCC
Configuration: P2RankProtocol: COACH420, trained on CHEN11 (protein-small molecule binding-site prediction)
Dataset: COACH420, trained on CHEN11
0.888 Recall
unitless · higher

Uncertainty: Not reported

Coverage: Not reported scored / Not reported eligible

Result quoted from another source · Source checked
Methods, coverage and source

P2Rank: COACH420, trained on CHEN11

Residue-level small-molecule binding-site classification. CHEN11 training, COACH420 test.

Aggregation: Not reported

Protein-small molecule binding site prediction based on a pre-trained protein language model with contrastive learning · Table 2 (Tab2), row 2 P2Rank, column 2: COACH420, trained on CHEN11 Recall
Configuration: CLAPE-SMBProtocol: COACH420, trained on CHEN11 (protein-small molecule binding-site prediction)
Dataset: COACH420, trained on CHEN11
0.412 ± 0.057 Precision
unitless · higher

Uncertainty: printed: 0.057; value: 0.057; type: not explicitly identified in inspected table or caption

Coverage: Not reported scored / Not reported eligible

Author-reported evaluation · Source checked
Methods, coverage and source

CLAPE-SMB: COACH420, trained on CHEN11

Residue-level small-molecule binding-site classification. CHEN11 training, COACH420 test.

Aggregation: Not reported

Protein-small molecule binding site prediction based on a pre-trained protein language model with contrastive learning · Table 2 (Tab2), row 4 CLAPE-SMB, column 3: COACH420, trained on CHEN11 Precision
Configuration: P2RankProtocol: COACH420, trained on CHEN11 (protein-small molecule binding-site prediction)
Dataset: COACH420, trained on CHEN11
0.224 MCC
unitless · higher

Uncertainty: Not reported

Coverage: Not reported scored / Not reported eligible

Result quoted from another source · Source checked
Methods, coverage and source

P2Rank: COACH420, trained on CHEN11

Residue-level small-molecule binding-site classification. CHEN11 training, COACH420 test.

Aggregation: Not reported

Protein-small molecule binding site prediction based on a pre-trained protein language model with contrastive learning · Table 2 (Tab2), row 2 P2Rank, column 4: COACH420, trained on CHEN11 MCC

Source checking is not independent reproduction. Release 2026-09-29-06401fd5b220.

Dataset and evaluation context

A dataset supplies biological observations. The evaluation protocol defines how those observations are split, used and scored.

Evidence

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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.

6 evidence rows matching the loaded filters

Claims, original sources and review scope · Release 2026-09-29-06401fd5b220
Property and statementOriginal source and locationReview and provenance
attributes.reported_population
Not reported
Context-only references
Protein-small molecule binding site prediction based on a pre-trained protein language model with contrastive learning

Original source ↗

Comparison of CLAPE-SMB with other models trained on CHEN11 and tested on COACH420; Table 2 (Tab2), row 2 P2Rank, column 2: COACH420, trained on CHEN11 Recall; Table 2 (Tab2), row 3 GraphBind, column 2: COACH420, trained on CHEN11 Recall; Table 2 (Tab2), row 4 CLAPE-SMB, column 2: COACH420, trained on CHEN11 Recall

Version: version of record
Retrieved: 2026-09-16T10:41:06Z

missing or unspecified

No individual claim review recorded

Audit details

Field: attributes.reported_population

Source artifact SHA-256: 215919244c3dd2dfb0b55fce91c211430fd8d4aee4bb28bd03eab9f4feb73e62

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

Inspected artifact

attributes.source_locator
Comparison of CLAPE-SMB with other models trained on CHEN11 and tested on COACH420; Table 2 (Tab2), row 2 P2Rank, column 2: COACH420, trained on CHEN11 Recall; Table 2 (Tab2), row 3 GraphBind, column 2: COACH420, trained on CHEN11 Recall; Table 2 (Tab2), row 4 CLAPE-SMB, column 2: COACH420, trained on CHEN11 Recall
Context-only references
Protein-small molecule binding site prediction based on a pre-trained protein language model with contrastive learning

Original source ↗

Comparison of CLAPE-SMB with other models trained on CHEN11 and tested on COACH420; Table 2 (Tab2), row 2 P2Rank, column 2: COACH420, trained on CHEN11 Recall; Table 2 (Tab2), row 3 GraphBind, column 2: COACH420, trained on CHEN11 Recall; Table 2 (Tab2), row 4 CLAPE-SMB, column 2: COACH420, trained on CHEN11 Recall

Version: version of record
Retrieved: 2026-09-16T10:41:06Z

not individually reviewed

No individual claim review recorded

Audit details

Field: attributes.source_locator

Source artifact SHA-256: 215919244c3dd2dfb0b55fce91c211430fd8d4aee4bb28bd03eab9f4feb73e62

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

Inspected artifact

attributes.split
Residue-level small-molecule binding-site classification. CHEN11 training, COACH420 test.
Context-only references
Protein-small molecule binding site prediction based on a pre-trained protein language model with contrastive learning

Original source ↗

Comparison of CLAPE-SMB with other models trained on CHEN11 and tested on COACH420; Table 2 (Tab2), row 2 P2Rank, column 2: COACH420, trained on CHEN11 Recall; Table 2 (Tab2), row 3 GraphBind, column 2: COACH420, trained on CHEN11 Recall; Table 2 (Tab2), row 4 CLAPE-SMB, column 2: COACH420, trained on CHEN11 Recall

Version: version of record
Retrieved: 2026-09-16T10:41:06Z

not individually reviewed

No individual claim review recorded

Audit details

Field: attributes.split

Source artifact SHA-256: 215919244c3dd2dfb0b55fce91c211430fd8d4aee4bb28bd03eab9f4feb73e62

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

Inspected artifact

attributes.subset
Not reported
Context-only references
Protein-small molecule binding site prediction based on a pre-trained protein language model with contrastive learning

Original source ↗

Comparison of CLAPE-SMB with other models trained on CHEN11 and tested on COACH420; Table 2 (Tab2), row 2 P2Rank, column 2: COACH420, trained on CHEN11 Recall; Table 2 (Tab2), row 3 GraphBind, column 2: COACH420, trained on CHEN11 Recall; Table 2 (Tab2), row 4 CLAPE-SMB, column 2: COACH420, trained on CHEN11 Recall

Version: version of record
Retrieved: 2026-09-16T10:41:06Z

missing or unspecified

No individual claim review recorded

Audit details

Field: attributes.subset

Source artifact SHA-256: 215919244c3dd2dfb0b55fce91c211430fd8d4aee4bb28bd03eab9f4feb73e62

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

Inspected artifact

description
Dataset and cohort used in the cited comparison. Dataset population counts do not establish successful prediction coverage.
Context-only references
Protein-small molecule binding site prediction based on a pre-trained protein language model with contrastive learning

Original source ↗

Comparison of CLAPE-SMB with other models trained on CHEN11 and tested on COACH420; Table 2 (Tab2), row 2 P2Rank, column 2: COACH420, trained on CHEN11 Recall; Table 2 (Tab2), row 3 GraphBind, column 2: COACH420, trained on CHEN11 Recall; Table 2 (Tab2), row 4 CLAPE-SMB, column 2: COACH420, trained on CHEN11 Recall

Version: version of record
Retrieved: 2026-09-16T10:41:06Z

not individually reviewed

No individual claim review recorded

Audit details

Field: description

Source artifact SHA-256: 215919244c3dd2dfb0b55fce91c211430fd8d4aee4bb28bd03eab9f4feb73e62

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

Inspected artifact

name
COACH420, trained on CHEN11
Context-only references
Protein-small molecule binding site prediction based on a pre-trained protein language model with contrastive learning

Original source ↗

Comparison of CLAPE-SMB with other models trained on CHEN11 and tested on COACH420; Table 2 (Tab2), row 2 P2Rank, column 2: COACH420, trained on CHEN11 Recall; Table 2 (Tab2), row 3 GraphBind, column 2: COACH420, trained on CHEN11 Recall; Table 2 (Tab2), row 4 CLAPE-SMB, column 2: COACH420, trained on CHEN11 Recall

Version: version of record
Retrieved: 2026-09-16T10:41:06Z

not individually reviewed

No individual claim review recorded

Audit details

Field: name

Source artifact SHA-256: 215919244c3dd2dfb0b55fce91c211430fd8d4aee4bb28bd03eab9f4feb73e62

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

Inspected artifact

Sources and history

View linked audit checks and correction history

Release 2026-09-29-06401fd5b220 · Record review: needs review

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

Stable ID: paper-dataset-d71026cdf5608821b0

areas
proteins-complexes
tasks
protein-small molecule binding-site prediction
split
Residue-level small-molecule binding-site classification. CHEN11 training, COACH420 test.
subset
Not reported
reported population
Not reported
source locator
Comparison of CLAPE-SMB with other models trained on CHEN11 and tested on COACH420; Table 2 (Tab2), row 2 P2Rank, column 2: COACH420, trained on CHEN11 Recall; Table 2 (Tab2), row 3 GraphBind, column 2: COACH420, trained on CHEN11 Recall; Table 2 (Tab2), row 4 CLAPE-SMB, column 2: COACH420, trained on CHEN11 Recall
missing metadata
manifest: unextracted; scored count: unreported
entity classification
review date: 2026-09-17; rationale: This record identifies a biological data collection or source-labelled evaluation cohort. Keep its dataset identity; split, assay, taxonomic level, candidate restrictions and comparison context remain attributes rather than automatically becoming new entity kinds.; source ids: clape-smb-2024; source locator: Comparison of CLAPE-SMB with other models trained on CHEN11 and tested on COACH420; Table 2 (Tab2), row 2 P2Rank, column 2: COACH420, trained on CHEN11 Recall; Table 2 (Tab2), row 3 GraphBind, column 2: COACH420, trained on CHEN11 Recall; Table 2 (Tab2), row 4 CLAPE-SMB, column 2: COACH420, trained on CHEN11 Recall; ambiguities: None recorded
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