Evaluation for drugmechdb

Evaluator: Not specified

Evaluated on: 2025-08-26

This is a manual evaluation intended to identify potential barriers to reuse.


Access Level and Types

QuestionAnswerComment
Access to data outside of the knowledge graphYPaths that describe the mechanism of action for drug/disease indication pair
API or online access to the knowledge graphYWebsite, can view all paths or only those related to a specific drug or disease
Multiple access options availableYCan download from zenodo or use website
Source code availabilityYHttps://github.com/SuLab/DrugMechDB
Downloadable knowledge graphYKind of on zenodo, but what they are calling a KG is a collection of entries for drug/disease pairs and the paths connecting them. Raw KG containing all edges between all entries does not appear to exist

Section Score: 5/5

Provenance of Nodes and Edges

QuestionAnswerComment
Source list providedYTable with node sources. Indications: DrugCentral ( according to GH, randomly sampled from availble drug-disease pairs, does not include all of them), paths: Mechanism of Action section from DrugBank, description section within Inxight Drugs, review articles, GeneOntology , UniProt, Reactome, and well-sources Wikipedia articles. No Primary experimental results are included. All are verified by curators
Source versions informationNDate given for DrugCentral download, cannot find info for other sources
Import dependenciesYThere are requirements.txt and .yaml files in the KG's downloadable .zip file on Zenodo (https://zenodo.org/records/8139357) showing the dependencies.
Node and edge sourcesYEach entry consist of ‘graph’, ‘links’, ‘nodes’, and ‘reference’ keys. Graph contains the drug/disease pair, links contains relationships informative to the indication, nodes contains information about all entities in link, and reference contains all the sources for the entire relationship but not specifically for individual nodes/edges
Edges deduplicationNPaths are manually curated
Triples source detailsNEdges between informative nodes in a path do not contain orignal source infromation. Informative paths have citations for the entire path, not indivudal triples within them.
Edge type schemaYBioLink, but does not specify exactly what sources are used for each edge type

Section Score: 4/7

Documented standards, schema, construction

QuestionAnswerComment
Biological usable dataYJson files
Resolvable IDsYAll nodes come from existing sources
Construction documentationNNot really. Everything is "manually curated"
Transformation documentationN
Schema usedYBioLink

Section Score: 3/5

Update frequency and versioning

QuestionAnswerComment
Stable versionsY
Public tracker informationYGitHub Issues. Also includes a guide for how users can submit their own curated paths.
Knowledge graph contact informationYIndirectly. website indicated the lab who owns it, but does not provide a point of contact
Updated annuallyNV1 released in 2019 with one update less than a year later, same with V2 in 2023, no other updates
Prior versions accessNAll versions availble, V2 has publication associated but detailed change logs for minor updates not available

Section Score: 3/5

Evaluation - Metrics and Fitness for Purpose

QuestionAnswerComment
Use case providedN
Evaluation against other modelsYThey used an external KG to evaluate agreement between types of associations present in both graphs and calculate a p-value representing when the simulated percentage of matching was greater than or equal to the observed percentage
Defined scopeYMechanisms of action by which a drug treats a disease
Multiple evaluation methodsN
Accuracy metricsYAgreement with MechRepoNet

Section Score: 3/5

License Information

QuestionAnswerComment
LicenseCC0 1.0 Universal