Integrating AI in Medicinal Chemistry for Accelerated Drug Discovery: A Comprehensive SAR (CSAR) Optimization Strategy and Discovery of Potent ALDH3A1 Inhibitors.
- DOI
- 10.1021/acs.jmedchem.6c00537
- Published
- 2026 Jun 11
- Container
- Journal of medicinal chemistry
- Publisher
- Not recorded
- Open access
- yes
Credibility signals
limited evidence Score 45/100 under policy 1.0.0. This is a metadata assessment, not a judgment of the paper's conclusions.
Show all credibility signals
- cautionDOI registered: No matching Crossref record was present in this response.
- cautionDOI resolves: No matching Crossref record was present in this response.
- not scoredDirectory of Open Access Journals: No matching DOAJ record was present in this response. No allow-list match; this is not evidence of low credibility.
- not scoredMEDLINE indexed: Not checked or no result supplied; no credibility inference made.
- not scoredOpenAlex core source: Not checked or no result supplied; no credibility inference made.
- not scoredKnown publisher allow-list: Not checked or no result supplied; no credibility inference made.
- not scoredROR affiliation: Not checked or no result supplied; no credibility inference made.
- not scoredRetraction Watch retraction: No retraction notice matched this DOI in the deployed snapshot. No matching event found; coverage may be incomplete.
- not scoredRetraction Watch expression of concern: No expression of concern notice matched this DOI in the deployed snapshot. No matching event found; coverage may be incomplete.
- not scoredRetraction Watch correction: No correction notice matched this DOI in the deployed snapshot. No matching event found; coverage may be incomplete.
- not scoredRetraction Watch reinstatement: No reinstatement notice matched this DOI in the deployed snapshot. No matching event found; coverage may be incomplete.
- supportingOpen access status: Normalized open-access status: open.
- not scoredPublication license: Not checked or no result supplied; no credibility inference made.
- not scoredPublication version: A publication version was supplied but is not scored.
- cautionMetadata completeness: 5 of 6 scored descriptive metadata groups are present; missing fields increase uncertainty.
Cite this work
BibTeX
@article{allodium:10.1021/acs.jmedchem.6c00537,
title = {Integrating AI in Medicinal Chemistry for Accelerated Drug Discovery: A Comprehensive SAR (CSAR) Optimization Strategy and Discovery of Potent ALDH3A1 Inhibitors.},
author = {Jain S and Yasgar A and Dalal A and Nilova A and Davies M and Baljinnyam B and Qu Y and Denson JP and Esposito D and Tao D and Yang SM and Talley DC and Simeonov A and Martinez NJ and Rai G and Zakharov AV},
year = {2026},
journal = {Journal of medicinal chemistry},
doi = {10.1021/acs.jmedchem.6c00537},
url = {https://doi.org/10.1021/acs.jmedchem.6c00537}
}RIS
TY - JOUR TI - Integrating AI in Medicinal Chemistry for Accelerated Drug Discovery: A Comprehensive SAR (CSAR) Optimization Strategy and Discovery of Potent ALDH3A1 Inhibitors. AU - Jain S AU - Yasgar A AU - Dalal A AU - Nilova A AU - Davies M AU - Baljinnyam B AU - Qu Y AU - Denson JP AU - Esposito D AU - Tao D AU - Yang SM AU - Talley DC AU - Simeonov A AU - Martinez NJ AU - Rai G AU - Zakharov AV PY - 2026 JO - Journal of medicinal chemistry DO - 10.1021/acs.jmedchem.6c00537 UR - https://doi.org/10.1021/acs.jmedchem.6c00537 ER -
APA
S, J., A, Y., A, D., A, N., M, D., B, B., Y, Q., JP, D., D, E., D, T., SM, Y., DC, T., A, S., NJ, M., G, R., & AV, Z. (2026). Integrating AI in Medicinal Chemistry for Accelerated Drug Discovery: A Comprehensive SAR (CSAR) Optimization Strategy and Discovery of Potent ALDH3A1 Inhibitors.. Journal of medicinal chemistry. https://doi.org/10.1021/acs.jmedchem.6c00537
Source records
- pubmed · retrieved 2026-09-26T02:31:18.712Z
- europe-pmc · retrieved 2026-09-26T02:31:18.730Z