Hermann Kroll
Computer Scientist
Wolf-Tilo Balke
Professor
Christina Draheim
Pharmacist
Stefan Wulle
Pharmacist
Johannes Ruthmann
Research Assistant
Jan Pirklbauer
Research Assistant
Morris Kunz
Research Assistant
Pascal Sackhoff
Research Assistant
Bill Matthias Thang
Research Assistant
Concept Type | Source | Description |
---|---|---|
Chemical | ChEMBL | general chemicals |
Drug | ChEMBL | active ingredients/drug/substances (no trade names) |
Disease | MeSH | diseases, symptoms, side effects |
Dosage Form | MeSH + Custom | forms in which a drug is administered / bound |
Excipient | Custom | ingredients / chemicals that are used in dosage forms |
HealthStatus | MeSH | Status for patients (women, men, alcoholics, ...) |
Method | MeSH | general methods for investigation |
LabMethod | MeSH | manually selected subset of Methods that are classfied as labor relevant methods |
PlantFamiliy/Genus | Wikidata | Plants (Families, Genus). Additional Cleaning is performed. |
Target | NCBI Genes | Pharmaceutical Targets (proteases, lactamase, ...) |
Vaccine | MeSH | Vaccines for different diseases |
Interaction | Explanation |
---|---|
associated | The general relation associated describes that two concepts are mentioned within the same sentence and connected via a verb/keyword. |
administered | Administered describes that some substance (Chemical, Drug, Excipient or Plant Family) is given in a dosage dorm (tablet, injection, etc.). |
compares | Compares describes that some concepts are compared. |
decreases | Decreases describes that some effect is lowered, e.g., a drug might lower the expression of some target. A search for decreases also includes searches for the inhibits relation. |
induces | Induces describes that some effect / expression is increased, e.g., a drug might increase the expression of a disease. Induces may be used to search for side effects. |
interacts | Interacts describe an interaction between concepts (drugs, targets, etc.). A search for interacts also includes searches for metabolises and inhibits. |
inhibits | Inhibits describes an inhibition of some target, e.g., a drug might inhibit some target. |
metabolises | Metabolises describes that a target is metabolised by some substance, e.g., a drug might be metabolised by a target. |
method | Method describes a relation that involves a method or lab method, e.g., a drug might be analysed via a method. |
treats | Treats describe that some disease or species is treated with a substance (Chemical, Drug, Excipient), e.g., a drug might prevent or lower the expression of some disease. |
The following table displays which regular expressions and synonyms we consider to represent an interaction. We also provide this list as a JSON file.
Interaction | Explanation |
---|---|
associated | General relation. Any predicate and those special words: associat*, contain, produce, convert, yield, isolate, generate, synthesize, grow, occures, evaluat*, augment, effect, develop*, affect, contribut*, involve, isa, same as, coexists with, process, part of, associate, play, limit, show, present, exhibit, find, form |
administered | Relation between Dosage Forms and any other concept. receiv*, administrat* |
compares | compar*, correlate*, correspond* |
decreases | reduc*, lower*, attenuat*, mediate, downregulat*, down-regulat*, down regulat* |
induces | stimulat*, increas*, potentiat*, enhanc*, activat*, lead, cause, side effect*, adverse, complication*, drug toxicit*, drug injur*, upregulat*, up regulat*, up-regulat* |
interacts | bind, interact*, target*, regulat*, block* |
inhibits | disrupt*, suppres*, inhibit*, disturb* |
metabolises | metabol* |
method | Relation between Methods and any other concept. method* |
treats | prevent*, use, improv*, promot*, sensiti*, aid, treat*, *therap* |
The following hierarchy displays how interactions are expanded in our system, e.g., associated is expanded to any other relation or interacts is expanded to inhibits or metabolises.