CACHE #3 normalised merged-library results: metric_qualifier corrected to the stored formula
Metric qualifier of CACHE #3 merged Round 1 library prediction per workflow (Herasymenko et al. 2026 Table S8)
Confirmed Tier 1 (chemically novel) hits among the workflow's predicted actives on the merged 1739-compound library, per 1000 compounds predicted active. The cell is stored as the formula 1000*N/L, that is 1000 times the Tier 1 count in column N divided by the predicted-active count in column L. | Confirmed Tier 2 (not novel) hits among the workflow's predicted actives on the merged 1739-compound library, per 1000 compounds predicted active. The cell is stored as the formula 1000*O/L, that is 1000 times the Tier 2 count in column O divided by the predicted-active count in column L. | Confirmed Tier 1 and Tier 2 hits combined among the workflow's predicted actives on the merged 1739-compound library, per 1000 compounds predicted active. The cell is stored as the formula R+S, the sum of the two preceding columns.
The workbook stores these cells as 1000*N/L, 1000*O/L and R+S, so each is confirmed Tier 1 or Tier 2 hits per 1000 compounds predicted active. The previous qualifiers said only 'normalised value' and hid the per-1000 scaling. Affects the 57 results on columns R, S and T of sheet S8.
Evidence
Source checking verifies the cited claim or transcription. It does not establish independent reproduction.
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.
14 evidence rows matching the loaded filters
| Property and statement | Original source and location | Review and provenance |
|---|---|---|
| Claimed field attributes.metric_qualifier Context-only references | Herasymenko et al. 2026, J Chem Inf Model (CACHE Challenge #3, Europe PMC full text) Sheet 'S8', columns R, S and T; the stored cell formulas in xl/worksheets/sheet9.xml Shared locator for this statement’s cited sources; not a separate locator for each citation. Version: PMC12892310 (J Chem Inf Model, published 2026-01-21) | not individually reviewed No individual claim review recorded Audit detailsField: Source artifact SHA-256: Hash scope: Hash scope not separately documented; inspect source record |
| Claimed field attributes.metric_qualifier Context-only references | Herasymenko et al. 2026, CACHE Challenge #3, Supporting Information workbook ci5c02441_si_002.xlsx Sheet 'S8', columns R, S and T; the stored cell formulas in xl/worksheets/sheet9.xml Shared locator for this statement’s cited sources; not a separate locator for each citation. Version: ci5c02441_si_002.xlsx, member of the Europe PMC supplementary archive of PMC12892310 | not individually reviewed No individual claim review recorded 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 |
| Previous value Normalised Tier 1 value / Normalised Tier 2 value / Sum of the normalised Tier 1 and Tier 2 values for the workflow's predicted-active compounds on the merged library Context-only references | Herasymenko et al. 2026, J Chem Inf Model (CACHE Challenge #3, Europe PMC full text) Sheet 'S8', columns R, S and T; the stored cell formulas in xl/worksheets/sheet9.xml Shared locator for this statement’s cited sources; not a separate locator for each citation. Version: PMC12892310 (J Chem Inf Model, published 2026-01-21) | not individually reviewed No individual claim review recorded Audit detailsField: Source artifact SHA-256: Hash scope: Hash scope not separately documented; inspect source record |
| Previous value Normalised Tier 1 value / Normalised Tier 2 value / Sum of the normalised Tier 1 and Tier 2 values for the workflow's predicted-active compounds on the merged library Context-only references | Herasymenko et al. 2026, CACHE Challenge #3, Supporting Information workbook ci5c02441_si_002.xlsx Sheet 'S8', columns R, S and T; the stored cell formulas in xl/worksheets/sheet9.xml Shared locator for this statement’s cited sources; not a separate locator for each citation. Version: ci5c02441_si_002.xlsx, member of the Europe PMC supplementary archive of PMC12892310 | not individually reviewed No individual claim review recorded 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 |
| Source location Sheet 'S8', columns R, S and T; the stored cell formulas in xl/worksheets/sheet9.xml Context-only references | Herasymenko et al. 2026, J Chem Inf Model (CACHE Challenge #3, Europe PMC full text) Sheet 'S8', columns R, S and T; the stored cell formulas in xl/worksheets/sheet9.xml Shared locator for this statement’s cited sources; not a separate locator for each citation. Version: PMC12892310 (J Chem Inf Model, published 2026-01-21) | not individually reviewed No individual claim review recorded Audit detailsField: Source artifact SHA-256: Hash scope: Hash scope not separately documented; inspect source record |
| Source location Sheet 'S8', columns R, S and T; the stored cell formulas in xl/worksheets/sheet9.xml Context-only references | Herasymenko et al. 2026, CACHE Challenge #3, Supporting Information workbook ci5c02441_si_002.xlsx Sheet 'S8', columns R, S and T; the stored cell formulas in xl/worksheets/sheet9.xml Shared locator for this statement’s cited sources; not a separate locator for each citation. Version: ci5c02441_si_002.xlsx, member of the Europe PMC supplementary archive of PMC12892310 | not individually reviewed No individual claim review recorded 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 |
| Claimed value Confirmed Tier 1 (chemically novel) hits among the workflow's predicted actives on the merged 1739-compound library, per 1000 compounds predicted active. The cell is stored as the formula 1000*N/L, that is 1000 times the Tier 1 count in column N divided by the predicted-active count in column L. | Confirmed Tier 2 (not novel) hits among the workflow's predicted actives on the merged 1739-compound library, per 1000 compounds predicted active. The cell is stored as the formula 1000*O/L, that is 1000 times the Tier 2 count in column O divided by the predicted-active count in column L. | Confirmed Tier 1 and Tier 2 hits combined among the workflow's predicted actives on the merged 1739-compound library, per 1000 compounds predicted active. The cell is stored as the formula R+S, the sum of the two preceding columns. Context-only references | Herasymenko et al. 2026, J Chem Inf Model (CACHE Challenge #3, Europe PMC full text) Sheet 'S8', columns R, S and T; the stored cell formulas in xl/worksheets/sheet9.xml Shared locator for this statement’s cited sources; not a separate locator for each citation. Version: PMC12892310 (J Chem Inf Model, published 2026-01-21) | not individually reviewed No individual claim review recorded Audit detailsField: Source artifact SHA-256: Hash scope: Hash scope not separately documented; inspect source record |
| Claimed value Confirmed Tier 1 (chemically novel) hits among the workflow's predicted actives on the merged 1739-compound library, per 1000 compounds predicted active. The cell is stored as the formula 1000*N/L, that is 1000 times the Tier 1 count in column N divided by the predicted-active count in column L. | Confirmed Tier 2 (not novel) hits among the workflow's predicted actives on the merged 1739-compound library, per 1000 compounds predicted active. The cell is stored as the formula 1000*O/L, that is 1000 times the Tier 2 count in column O divided by the predicted-active count in column L. | Confirmed Tier 1 and Tier 2 hits combined among the workflow's predicted actives on the merged 1739-compound library, per 1000 compounds predicted active. The cell is stored as the formula R+S, the sum of the two preceding columns. Context-only references | Herasymenko et al. 2026, CACHE Challenge #3, Supporting Information workbook ci5c02441_si_002.xlsx Sheet 'S8', columns R, S and T; the stored cell formulas in xl/worksheets/sheet9.xml Shared locator for this statement’s cited sources; not a separate locator for each citation. Version: ci5c02441_si_002.xlsx, member of the Europe PMC supplementary archive of PMC12892310 | not individually reviewed No individual claim review recorded 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 |
| Description The workbook stores these cells as 1000*N/L, 1000*O/L and R+S, so each is confirmed Tier 1 or Tier 2 hits per 1000 compounds predicted active. The previous qualifiers said only 'normalised value' and hid the per-1000 scaling. Affects the 57 results on columns R, S and T of sheet S8. Context-only references | Herasymenko et al. 2026, J Chem Inf Model (CACHE Challenge #3, Europe PMC full text) Sheet 'S8', columns R, S and T; the stored cell formulas in xl/worksheets/sheet9.xml Shared locator for this statement’s cited sources; not a separate locator for each citation. Version: PMC12892310 (J Chem Inf Model, published 2026-01-21) | not individually reviewed No individual claim review recorded Audit detailsField: Source artifact SHA-256: Hash scope: Hash scope not separately documented; inspect source record |
| Description The workbook stores these cells as 1000*N/L, 1000*O/L and R+S, so each is confirmed Tier 1 or Tier 2 hits per 1000 compounds predicted active. The previous qualifiers said only 'normalised value' and hid the per-1000 scaling. Affects the 57 results on columns R, S and T of sheet S8. Context-only references | Herasymenko et al. 2026, CACHE Challenge #3, Supporting Information workbook ci5c02441_si_002.xlsx Sheet 'S8', columns R, S and T; the stored cell formulas in xl/worksheets/sheet9.xml Shared locator for this statement’s cited sources; not a separate locator for each citation. Version: ci5c02441_si_002.xlsx, member of the Europe PMC supplementary archive of PMC12892310 | not individually reviewed No individual claim review recorded 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 |
Sources and history
Release 2026-10-22-1b7cf027e4f6 · Record review: source checked
2 source records and release history
- Herasymenko et al. 2026, CACHE Challenge #3, Supporting Information workbook ci5c02441_si_002.xlsx · Original source · ci5c02441_si_002.xlsx, member of the Europe PMC supplementary archive of PMC12892310
- Herasymenko et al. 2026, J Chem Inf Model (CACHE Challenge #3, Europe PMC full text) · Original source · PMC12892310 (J Chem Inf Model, published 2026-01-21)
Technical metadata and extraction receipts
Stable ID: metadata-correction-7eaef94c57753b967ce9
- areas
- molecular-interactions
- contexts
- research
- field
- attributes.metric_qualifier
- previous value
- Normalised Tier 1 value / Normalised Tier 2 value / Sum of the normalised Tier 1 and Tier 2 values for the workflow's predicted-active compounds on the merged library
- value
- Confirmed Tier 1 (chemically novel) hits among the workflow's predicted actives on the merged 1739-compound library, per 1000 compounds predicted active. The cell is stored as the formula 1000*N/L, that is 1000 times the Tier 1 count in column N divided by the predicted-active count in column L. | Confirmed Tier 2 (not novel) hits among the workflow's predicted actives on the merged 1739-compound library, per 1000 compounds predicted active. The cell is stored as the formula 1000*O/L, that is 1000 times the Tier 2 count in column O divided by the predicted-active count in column L. | Confirmed Tier 1 and Tier 2 hits combined among the workflow's predicted actives on the merged 1739-compound library, per 1000 compounds predicted active. The cell is stored as the formula R+S, the sum of the two preceding columns.
- source locator
- Sheet 'S8', columns R, S and T; the stored cell formulas in xl/worksheets/sheet9.xml
- review
- method: scope-review; independent-cell-check; reviewer: claude; reviewer note: Claude review agent, independent of the extraction agent; no human review claimed; date: 2026-10-22; method note: Read the stored formulas from xl/worksheets/sheet9.xml of the pinned workbook: R is 1000*N/L, S is 1000*O/L and T is R+S.; note: Correction found by the independent review pass of batch use-case-coverage-hitdisc-20261022. The previous value is kept here.; receipt: data/omics/use-case-coverage-hitdisc-20261022/review.json