ArticleFuture science OA2021
State-of-the-art of artificial intelligence in medicinal chemistry.
Article in Future science OA, 2021. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 13 papers.
What it found
Each row is one number read from the abstract, on the scale the paper reported it, with its interval. Left of the dashed line favours the treatment, right favours the comparator. Under each row is the sentence it came from. New to these charts? A ten-minute tutorial.
The abstract states no effect estimate the extractor could read, or names no intervention and outcome on the map, so this paper lights no cell and moves no belief. It is still indexed, cited and linked below.
The trial behind it
Trials whose registry record cites this paper, or whose number appears in the abstract. A trial that started after this paper was published is citing it as background, not reporting it.
Neither the registry nor the abstract names a trial number. If this is a trial report, that itself is worth knowing.
Who cites it
13 citing papers in PubMed.
- From data to discovery: The rise of information-theoretic predictive models in drug development.Scientific reports · 2026Article
- Big Data for Drug Discovery: Some Historical Landscape, Considerations, and Applications for a Medicinal Chemist.ACS omega · 2026Review
- Development of a novel representation of drug 3D structures and enhancement of the TSR-based method for probing drug and target interactions.Computational biology and chemistry · 2024Article
- Relationship between prediction accuracy and uncertainty in compound potency prediction using deep neural networks and control models.Scientific reports · 2024Article
- Calculation of exact Shapley values for explaining support vector machine models using the radial basis function kernel.Scientific reports · 2023Article
- Differences in learning characteristics between support vector machine and random forest models for compound classification revealed by Shapley value analysis.Scientific reports · 2023Article
- Predicting Potent Compounds Using a Conditional Variational Autoencoder Based upon a New Structure-Potency Fingerprint.Biomolecules · 2023Article
- Computational analysis, alignment and extension of analogue series from medicinal chemistry.Future science OA · 2022Article
- Artificial intelligence in interdisciplinary life science and drug discovery research.Future science OA · 2022Article
- Unsupervised Learning in Drug Design from Self-Organization to Deep Chemistry.International journal of molecular sciences · 2022Review
- Review
- Explainable machine learning predictions of dual-target compounds reveal characteristic structural features.Scientific reports · 2021Article
- Prediction of Molecular Properties Using Molecular Topographic Map.Molecules (Basel, Switzerland) · 2021Article
Corrections and comments
PubMed lists nothing against this paper. Absence here is not a guarantee, only a check that was made.
Authors and funding
1 author.
Funding
No grant is acknowledged in the PubMed record.
Abstract
PubMed holds no abstract for this paper.
Indexed as
Identifiers
What OpenQuestion holds
Registered trials
Read under generation 80e0d062 · epoch 390. Bibliography from PubMed, PubMed Central and OpenAlex; grants from NIH RePORTER; trial links from ClinicalTrials.gov; estimates, votes and beliefs from the OpenQuestion graph.