Ibrexafungerp Citrate
FDA-approved product (tablet, oral), marketed as Brexafemme.
- Registered studies
- 0
- Lab records
- 0
- Pathogens at ≥40%
- 4 of 4
Chemical structure
Existing / approved use
Documented · FDA, WHO, ChEMBLApproved for
- Vulvovaginal candidiasis
Indications ChEMBL records as approved, from FDA and DailyMed labels. Label ↗
- WHO therapeutic group
- Other antimycotics for systemic use
- Anti-infective classification
- Classified as another kind of anti-infective (for example an antifungal, antiviral or antiparasitic medicine).WHO ATC J02AX07
Repurposing investigation
This medicine is being investigated here for AI-predicted antimicrobial activity against MRSA, E. coli, K. pneumoniae and M. tuberculosis. It was surfaced computationally for further investigation; it is not an established treatment for these infections.
AI-predicted activity
AI prediction · nothing measured- MRSA63.5% AI-predicted activityAt or above the ≥40% mark this site uses to surface candidates.
- E. coli49.4% AI-predicted activityAt or above the ≥40% mark this site uses to surface candidates.
- K. pneumoniae44.7% AI-predicted activityAt or above the ≥40% mark this site uses to surface candidates.
- M. tuberculosis46.3% AI-predicted activityAt or above the ≥40% mark this site uses to surface candidates.
A model’s estimate of laboratory activity against each pathogen species. It is not clinical effectiveness.
Evidence
Clinical and experimental
Documented evidenceClinical
No evidence found
The registry was searched and no registered study names this medicine.
Experimental
No evidence found
No laboratory measurement against the four pathogens in the ChEMBL records loaded here.
Docking
Computational · nothing measuredDihydrofolate reductase ↗ (E. coli)
Not yet docked: queued in the docking rundetails
KPC-2 carbapenemase ↗ (K. pneumoniae)
Not yet docked: queued in the docking rundetails
Enoyl-ACP reductase (InhA) ↗ (M. tuberculosis)
Not yet docked: queued in the docking rundetails
Dihydrofolate reductase ↗ (MRSA)
Not yet docked: queued in the docking rundetails
AutoDock Vina, one experimentally solved protein per pathogen. This project’s screening target is -7.0 kcal/mol, its own mark rather than a universal cutoff. A docking score is a structural hypothesis, not proof of binding, and requires experimental validation.
Other medicines to investigate
AI prediction · nothing measuredOther repurposing candidates: approved medicines besides Ibrexafungerp Citrate with AI-predicted activity ≥40% against the chosen pathogen, leaving out existing antimicrobials. They are computational candidates for further investigation, not alternatives and not recommendations.
Sorted by AI-predicted activity, high to low. The order is not a ranking of which medicine is better.
- AdagrasibExisting use: Neoplasm, Non-small cell lung carcinoma56.9% AI-predicted activityagainst MRSA40 registered studies
- Lomitapide MesylateExisting use: Familial hypercholesterolemia, Homozygous familial hypercholesterolemia, Hypercholesterolemia56.9% AI-predicted activityagainst MRSANo documented evidence found
- BuprenorphineExisting use: Chronic pain, Drug dependence, Opioid dependence and 4 more56.9% AI-predicted activityagainst MRSA50+ registered studies
- IbrutinibExisting use: Cancer, Chronic lymphocytic leukemia, Macroglobulinemia and 3 more56.9% AI-predicted activityagainst MRSA50+ registered studies
- SimvastatinExisting use: Abnormal circulating lipid concentration, Acute myocardial infarction, Cardiovascular disease and 6 more56.8% AI-predicted activityagainst MRSA50+ registered studies
- DienogestExisting use: Menorrhagia56.8% AI-predicted activityagainst MRSA50+ registered studies
- Leniolisib PhosphateExisting use: Inborn error of immunity56.8% AI-predicted activityagainst MRSANo documented evidence found
- Lumateperone TosylateExisting use: Psychosis, Schizophrenia56.8% AI-predicted activityagainst MRSA6 registered studies
- Lurasidone HydrochlorideExisting use: Bipolar disorder, Bipolar I disorder, Schizophrenia56.8% AI-predicted activityagainst MRSA50+ registered studies
- Testosterone CypionateExisting use: Cancer, Hypogonadism, Hypogonadotropic hypogonadism and 5 more56.6% AI-predicted activityagainst MRSA50+ registered studies
- UbrogepantExisting use: Migraine disorder56.6% AI-predicted activityagainst MRSA24 registered studies
- Pipecuronium BromideExisting use: Other quaternary ammonium compounds56.6% AI-predicted activityagainst MRSA5 registered studies
Registered studies
A registration describes a study; it does not establish a positive result.
No evidence found: the registry was searched and no registered study names this medicine.