Published result; transcribed, not reproduced.
1 evaluation · 7 results. Different protocols are not a single leaderboard.
Protocol: CACHE #3 Round 1 own-selection outcome per workflow (Herasymenko et al. 2026 Table S8) · Dataset: CACHE #3 Round 1 compound library
Sorted by Cache challenge activity score (Activity score of the workflow's best confirmed Round 1 hit that was judged chemically novel) (higher is better). The best value in each column is highlighted. Decimals are rounded for display; each value links to the printed value and its source.
| Tested configuration | Cache challenge activity score (Activity score of the workflow's best confirmed Round 1 hit that was judged chemically novel) | Cache challenge activity score (Activity score of the workflow's best confirmed Round 1 hit) | Cache challenge activity score (Sum of the activity scores of all the workflow's confirmed Round 1 hits) | Cache challenge novelty score (Highest chemical novelty score among the workflow's confirmed Round 1 hits) | Count (Compounds the workflow selected that were synthesised and experimentally tested) | Count (Confirmed hits the Hit Evaluation Committee judged chemically novel, among the compounds the workflow selected) | Count (Experimentally confirmed hits among the compounds the workflow selected) |
|---|---|---|---|---|---|---|---|
| CACHE #3 workflow WF1689Evaluation | 0 | 0 | 0 | 0 | 89 | 0 | 0 |
Applied filters: All linked evaluations
| Tested configuration | Protocol and dataset | Finding | Evidence and details |
|---|---|---|---|
| Configuration: CACHE #3 workflow WF1689 | Protocol: CACHE #3 Round 1 own-selection outcome per workflow (Herasymenko et al. 2026 Table S8) Dataset: CACHE #3 Round 1 compound library | 89 Count (Compounds the workflow selected that were synthesised and experimentally tested) count · higher Uncertainty: Not reported by the source: The source prints no interval or spread for this value Coverage: Not reported scored / Not reported eligible | Author-reported evaluation · Source checkedMethods, coverage and sourceCACHE #3 workflow WF1689: own selection outcome hitdisc-20261022-protocol-cache3-own-selection Aggregation: Not reported Herasymenko et al. 2026, CACHE Challenge #3, Supporting Information workbook ci5c02441_si_002.xlsx · Sheet 'S8', row with Workflow = 1689, column D ('Compounds tested') |
| Configuration: CACHE #3 workflow WF1689 | Protocol: CACHE #3 Round 1 own-selection outcome per workflow (Herasymenko et al. 2026 Table S8) Dataset: CACHE #3 Round 1 compound library | 0 Count (Experimentally confirmed hits among the compounds the workflow selected) count · higher Uncertainty: Not reported by the source: The source prints no interval or spread for this value Coverage: Not reported scored / Not reported eligible | Author-reported evaluation · Source checkedMethods, coverage and sourceCACHE #3 workflow WF1689: own selection outcome hitdisc-20261022-protocol-cache3-own-selection Aggregation: Not reported Herasymenko et al. 2026, CACHE Challenge #3, Supporting Information workbook ci5c02441_si_002.xlsx · Sheet 'S8', row with Workflow = 1689, column E ('Hits') |
| Configuration: CACHE #3 workflow WF1689 | Protocol: CACHE #3 Round 1 own-selection outcome per workflow (Herasymenko et al. 2026 Table S8) Dataset: CACHE #3 Round 1 compound library | 0 Count (Confirmed hits the Hit Evaluation Committee judged chemically novel, among the compounds the workflow selected) count · higher Uncertainty: Not reported by the source: The source prints no interval or spread for this value Coverage: Not reported scored / Not reported eligible | Author-reported evaluation · Source checkedMethods, coverage and sourceCACHE #3 workflow WF1689: own selection outcome hitdisc-20261022-protocol-cache3-own-selection Aggregation: Not reported Herasymenko et al. 2026, CACHE Challenge #3, Supporting Information workbook ci5c02441_si_002.xlsx · Sheet 'S8', row with Workflow = 1689, column F ('Chemically Novel Hits') |
| Configuration: CACHE #3 workflow WF1689 | Protocol: CACHE #3 Round 1 own-selection outcome per workflow (Herasymenko et al. 2026 Table S8) Dataset: CACHE #3 Round 1 compound library | 0 Cache challenge activity score (Activity score of the workflow's best confirmed Round 1 hit) unitless · higher Uncertainty: Not reported by the source: The source prints no interval or spread for this value Coverage: Not reported scored / Not reported eligible | Author-reported evaluation · Source checkedMethods, coverage and sourceCACHE #3 workflow WF1689: own selection outcome hitdisc-20261022-protocol-cache3-own-selection Aggregation: Not reported Herasymenko et al. 2026, CACHE Challenge #3, Supporting Information workbook ci5c02441_si_002.xlsx · Sheet 'S8', row with Workflow = 1689, column G ('Score of best hit') |
| Configuration: CACHE #3 workflow WF1689 | Protocol: CACHE #3 Round 1 own-selection outcome per workflow (Herasymenko et al. 2026 Table S8) Dataset: CACHE #3 Round 1 compound library | 0 Cache challenge activity score (Sum of the activity scores of all the workflow's confirmed Round 1 hits) unitless · higher Uncertainty: Not reported by the source: The source prints no interval or spread for this value Coverage: Not reported scored / Not reported eligible | Author-reported evaluation · Source checkedMethods, coverage and sourceCACHE #3 workflow WF1689: own selection outcome hitdisc-20261022-protocol-cache3-own-selection Aggregation: Not reported Herasymenko et al. 2026, CACHE Challenge #3, Supporting Information workbook ci5c02441_si_002.xlsx · Sheet 'S8', row with Workflow = 1689, column H ('Aggregated score') |
| Configuration: CACHE #3 workflow WF1689 | Protocol: CACHE #3 Round 1 own-selection outcome per workflow (Herasymenko et al. 2026 Table S8) Dataset: CACHE #3 Round 1 compound library | 0 Cache challenge novelty score (Highest chemical novelty score among the workflow's confirmed Round 1 hits) unitless · higher Uncertainty: Not reported by the source: The source prints no interval or spread for this value Coverage: Not reported scored / Not reported eligible | Author-reported evaluation · Source checkedMethods, coverage and sourceCACHE #3 workflow WF1689: own selection outcome hitdisc-20261022-protocol-cache3-own-selection Aggregation: Not reported Herasymenko et al. 2026, CACHE Challenge #3, Supporting Information workbook ci5c02441_si_002.xlsx · Sheet 'S8', row with Workflow = 1689, column I ('Top novelty score') |
| Configuration: CACHE #3 workflow WF1689 | Protocol: CACHE #3 Round 1 own-selection outcome per workflow (Herasymenko et al. 2026 Table S8) Dataset: CACHE #3 Round 1 compound library | 0 Cache challenge activity score (Activity score of the workflow's best confirmed Round 1 hit that was judged chemically novel) unitless · higher Uncertainty: Not reported by the source: The source prints no interval or spread for this value Coverage: Not reported scored / Not reported eligible | Author-reported evaluation · Source checkedMethods, coverage and sourceCACHE #3 workflow WF1689: own selection outcome hitdisc-20261022-protocol-cache3-own-selection Aggregation: Not reported Herasymenko et al. 2026, CACHE Challenge #3, Supporting Information workbook ci5c02441_si_002.xlsx · Sheet 'S8', row with Workflow = 1689, column J ('Top score of novel hits') |
Source checking is not independent reproduction. Release 2026-10-22-1b7cf027e4f6.
0 of 4 readiness checks met. These checks assess whether the evidence supports a reproducible investigation; a source-checked score alone does not meet them.
Release 2026-10-22-1b7cf027e4f6 · Evidence verified: Not verified
Exact outcomes, predictions, identifiers and evaluator are connected.
Missing or unresolved evidence
Verified: Not verified
Replay evidence includes annotations and an assessment of dependence. Unknown independence permits descriptive analysis only.
Missing or unresolved evidence
Verified: Not verified
A pinned recipe describes the inputs, environment and resource requirements.
Missing or unresolved evidence
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Separate data and exposure records support an independent test.
Missing or unresolved evidence
Verified: Not verified
Readiness describes the evidence in this release. Availability on your computer is checked separately when an investigation runs. Existing data exposure can prevent independent validation even when files are available.
No verified artifact manifest is connected to this record yet. The gaps above identify what is needed before analysis can begin.
CACHE #3 Round 1 own-selection outcome per workflow (Herasymenko et al. 2026 Table S8)
Metadata review: source checked. Unreported conditions prevent automatic comparisons.
No execution recipe has been verified for this exact configuration and evaluation. A benchmark's general instructions may use different inputs, splits or model settings.
Reproducing this published result requires matching its model configuration, data, split and scorer. Source checking or a successful smoke test does not establish score reproduction.
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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.
19 evidence rows matching the loaded filters
| Property and statement | Original source and location | Review and provenance |
|---|---|---|
| Comparison: adaptation Each team's own workflow, submitted before any experimental result was known Context-only references | Herasymenko et al. 2026, CACHE Challenge #3, Supporting Information workbook ci5c02441_si_002.xlsx Sheet 'S8', row with Workflow = 1689 Version: ci5c02441_si_002.xlsx, member of the Europe PMC supplementary archive of PMC12892310 | not individually reviewed No individual claim review recorded author reported Audit detailsField: Source artifact SHA-256: Hash scope: artifact_sha256 is the SHA-256 of the member file ci5c02441_si_002.xlsx. The Europe PMC supplementaryFiles endpoint assembles a zip per request, so the archive's own hash is not stable; the member file's bytes are. The publisher's direct supplement URL (https://pubs.acs.org/doi/suppl/10.1021/acs.jcim.5c02441/suppl_file/ci5c02441_si_002.xlsx) returned HTTP 403 on 2026-10-22. Archive member: ci5c02441_si_002.xlsx |
| Comparison: aggregation One value per workflow Context-only references | Herasymenko et al. 2026, CACHE Challenge #3, Supporting Information workbook ci5c02441_si_002.xlsx Sheet 'S8', row with Workflow = 1689 Version: ci5c02441_si_002.xlsx, member of the Europe PMC supplementary archive of PMC12892310 | not individually reviewed No individual claim review recorded author reported Audit detailsField: Source artifact SHA-256: Hash scope: artifact_sha256 is the SHA-256 of the member file ci5c02441_si_002.xlsx. The Europe PMC supplementaryFiles endpoint assembles a zip per request, so the archive's own hash is not stable; the member file's bytes are. The publisher's direct supplement URL (https://pubs.acs.org/doi/suppl/10.1021/acs.jcim.5c02441/suppl_file/ci5c02441_si_002.xlsx) returned HTTP 403 on 2026-10-22. Archive member: ci5c02441_si_002.xlsx |
| Comparison: budget Not reported Context-only references | Herasymenko et al. 2026, CACHE Challenge #3, Supporting Information workbook ci5c02441_si_002.xlsx Sheet 'S8', row with Workflow = 1689 Version: ci5c02441_si_002.xlsx, member of the Europe PMC supplementary archive of PMC12892310 | missing or unspecified No individual claim review recorded author reported Audit detailsField: Source artifact SHA-256: Hash scope: artifact_sha256 is the SHA-256 of the member file ci5c02441_si_002.xlsx. The Europe PMC supplementaryFiles endpoint assembles a zip per request, so the archive's own hash is not stable; the member file's bytes are. The publisher's direct supplement URL (https://pubs.acs.org/doi/suppl/10.1021/acs.jcim.5c02441/suppl_file/ci5c02441_si_002.xlsx) returned HTTP 403 on 2026-10-22. Archive member: ci5c02441_si_002.xlsx |
| Comparison: dataset version CACHE #3 Round 1, published 2026-01-21 Context-only references | Herasymenko et al. 2026, CACHE Challenge #3, Supporting Information workbook ci5c02441_si_002.xlsx Sheet 'S8', row with Workflow = 1689 Version: ci5c02441_si_002.xlsx, member of the Europe PMC supplementary archive of PMC12892310 | not individually reviewed No individual claim review recorded author reported Audit detailsField: Source artifact SHA-256: Hash scope: artifact_sha256 is the SHA-256 of the member file ci5c02441_si_002.xlsx. The Europe PMC supplementaryFiles endpoint assembles a zip per request, so the archive's own hash is not stable; the member file's bytes are. The publisher's direct supplement URL (https://pubs.acs.org/doi/suppl/10.1021/acs.jcim.5c02441/suppl_file/ci5c02441_si_002.xlsx) returned HTTP 403 on 2026-10-22. Archive member: ci5c02441_si_002.xlsx |
| Comparison: inputs The target and the commercial libraries for Round 1 selection; the merged list of all Round 1 compounds for the merged-library arm Context-only references | Herasymenko et al. 2026, CACHE Challenge #3, Supporting Information workbook ci5c02441_si_002.xlsx Sheet 'S8', row with Workflow = 1689 Version: ci5c02441_si_002.xlsx, member of the Europe PMC supplementary archive of PMC12892310 | not individually reviewed No individual claim review recorded author reported Audit detailsField: Source artifact SHA-256: Hash scope: artifact_sha256 is the SHA-256 of the member file ci5c02441_si_002.xlsx. The Europe PMC supplementaryFiles endpoint assembles a zip per request, so the archive's own hash is not stable; the member file's bytes are. The publisher's direct supplement URL (https://pubs.acs.org/doi/suppl/10.1021/acs.jcim.5c02441/suppl_file/ci5c02441_si_002.xlsx) returned HTTP 403 on 2026-10-22. Archive member: ci5c02441_si_002.xlsx |
| Comparison: metric implementation Counts of tested compounds and confirmed hits, and the challenge's activity, novelty and normalised scores Context-only references | Herasymenko et al. 2026, CACHE Challenge #3, Supporting Information workbook ci5c02441_si_002.xlsx Sheet 'S8', row with Workflow = 1689 Version: ci5c02441_si_002.xlsx, member of the Europe PMC supplementary archive of PMC12892310 | not individually reviewed No individual claim review recorded author reported Audit detailsField: Source artifact SHA-256: Hash scope: artifact_sha256 is the SHA-256 of the member file ci5c02441_si_002.xlsx. The Europe PMC supplementaryFiles endpoint assembles a zip per request, so the archive's own hash is not stable; the member file's bytes are. The publisher's direct supplement URL (https://pubs.acs.org/doi/suppl/10.1021/acs.jcim.5c02441/suppl_file/ci5c02441_si_002.xlsx) returned HTTP 403 on 2026-10-22. Archive member: ci5c02441_si_002.xlsx |
| Comparison: population The up-to-100 compounds this workflow selected, which Enamine synthesised and the organisers assayed Context-only references | Herasymenko et al. 2026, CACHE Challenge #3, Supporting Information workbook ci5c02441_si_002.xlsx Sheet 'S8', row with Workflow = 1689 Version: ci5c02441_si_002.xlsx, member of the Europe PMC supplementary archive of PMC12892310 | not individually reviewed No individual claim review recorded author reported Audit detailsField: Source artifact SHA-256: Hash scope: artifact_sha256 is the SHA-256 of the member file ci5c02441_si_002.xlsx. The Europe PMC supplementaryFiles endpoint assembles a zip per request, so the archive's own hash is not stable; the member file's bytes are. The publisher's direct supplement URL (https://pubs.acs.org/doi/suppl/10.1021/acs.jcim.5c02441/suppl_file/ci5c02441_si_002.xlsx) returned HTTP 403 on 2026-10-22. Archive member: ci5c02441_si_002.xlsx |
| Comparison: protocol id hitdisc-20261022-protocol-cache3-own-selection Context-only references | Herasymenko et al. 2026, CACHE Challenge #3, Supporting Information workbook ci5c02441_si_002.xlsx Sheet 'S8', row with Workflow = 1689 Version: ci5c02441_si_002.xlsx, member of the Europe PMC supplementary archive of PMC12892310 | not individually reviewed No individual claim review recorded author reported Audit detailsField: Source artifact SHA-256: Hash scope: artifact_sha256 is the SHA-256 of the member file ci5c02441_si_002.xlsx. The Europe PMC supplementaryFiles endpoint assembles a zip per request, so the archive's own hash is not stable; the member file's bytes are. The publisher's direct supplement URL (https://pubs.acs.org/doi/suppl/10.1021/acs.jcim.5c02441/suppl_file/ci5c02441_si_002.xlsx) returned HTTP 403 on 2026-10-22. Archive member: ci5c02441_si_002.xlsx |
| Comparison: split Whole Round 1 library; no training or test split applies Context-only references | Herasymenko et al. 2026, CACHE Challenge #3, Supporting Information workbook ci5c02441_si_002.xlsx Sheet 'S8', row with Workflow = 1689 Version: ci5c02441_si_002.xlsx, member of the Europe PMC supplementary archive of PMC12892310 | not individually reviewed No individual claim review recorded author reported Audit detailsField: Source artifact SHA-256: Hash scope: artifact_sha256 is the SHA-256 of the member file ci5c02441_si_002.xlsx. The Europe PMC supplementaryFiles endpoint assembles a zip per request, so the archive's own hash is not stable; the member file's bytes are. The publisher's direct supplement URL (https://pubs.acs.org/doi/suppl/10.1021/acs.jcim.5c02441/suppl_file/ci5c02441_si_002.xlsx) returned HTTP 403 on 2026-10-22. Archive member: ci5c02441_si_002.xlsx |
| Interpretation Blinded prospective challenge: predictions were submitted before any compound was synthesised or assayed. Context-only references | Herasymenko et al. 2026, CACHE Challenge #3, Supporting Information workbook ci5c02441_si_002.xlsx Sheet 'S8', row with Workflow = 1689 Version: ci5c02441_si_002.xlsx, member of the Europe PMC supplementary archive of PMC12892310 | not individually reviewed No individual claim review recorded author reported Audit detailsField: Source artifact SHA-256: Hash scope: artifact_sha256 is the SHA-256 of the member file ci5c02441_si_002.xlsx. The Europe PMC supplementaryFiles endpoint assembles a zip per request, so the archive's own hash is not stable; the member file's bytes are. The publisher's direct supplement URL (https://pubs.acs.org/doi/suppl/10.1021/acs.jcim.5c02441/suppl_file/ci5c02441_si_002.xlsx) returned HTTP 403 on 2026-10-22. Archive member: ci5c02441_si_002.xlsx |
Release 2026-10-22-1b7cf027e4f6 · Record review: source checked
Stable ID: hitdisc-20261022-eval-cache3-own-selection-wf1689