Results
Compound | ADE ID | ADE name | Score | Rank |
---|---|---|---|---|
[1] UntitledOriginal SMILES: Prepared SMILES: | MESHID:D014839 | Vomiting | 0.0747759 | 1 |
MESHID:D009325 | Nausea | 0.0747149 | 2 | |
MESHID:D010146 | Pain | 0.0739736 | 3 | |
MESHID:D006261 | Headache | 0.0707921 | 4 | |
MESHID:D006973 | Hypertension | 0.0703638 | 5 | |
MESHID:D009369 | Neoplasms | 0.0686771 | Known | |
MESHID:D000647 | Amnesia | 0.06843 | Known | |
MESHID:D004487 | Edema | 0.0663147 | Known | |
MESHID:D012640 | Seizures | 0.0642118 | 6 | |
MESHID:D004244 | Dizziness | 0.063588 | 7 | |
MESHID:D007022 | Hypotension | 0.0628216 | 8 | |
MESHID:D006470 | Hemorrhage | 0.0610546 | Known | |
MESHID:D011471 | Prostatic Neoplasms | 0.0603473 | Known | |
MESHID:D003556 | Cystitis | 0.059765 | Known | |
MESHID:D005076 | Exanthema | 0.0579095 | 9 | |
MESHID:D010190 | Pancreatic Neoplasms | 0.0576465 | Known | |
MESHID:D002471 | Cell Transformation, Neoplastic | 0.0519792 | Known | |
MESHID:D001862 | Bone Resorption | 0.0510585 | Known | |
MESHID:D007333 | Insulin Resistance | 0.0509999 | Known | |
UMLSID:C0015967 | body temperature increased | 0.0501807 | 10 | |
MESHID:D011537 | Pruritus | 0.049973 | 11 | |
MESHID:D001919 | Bradycardia | 0.0498543 | 12 | |
MESHID:D001145 | Arrhythmias, Cardiac | 0.0494779 | 13 | |
MESHID:D013610 | Tachycardia | 0.0482491 | 14 | |
UMLSID:C0013604 | NULL | 0.0477112 | 15 | |
MESHID:D015746 | Abdominal Pain | 0.0476255 | 16 | |
MESHID:D006967 | Hypersensitivity | 0.0468529 | 17 | |
MESHID:D007077 | Ileal Diseases | 0.0464719 | Known | |
MESHID:D014581 | Urticaria | 0.0452196 | 18 | |
UMLSID:C0011991 | Diarrhoea | 0.0450176 | 19 | |
MESHID:D000855 | Anorexia | 0.0446253 | 20 | |
UMLSID:C0002871 | anaemia | 0.0446203 | 21 | |
MESHID:D005221 | Fatigue | 0.0437897 | 22 | |
UMLSID:C0013404 | NULL | 0.0437038 | 23 | |
MESHID:D001007 | Anxiety | 0.0411577 | 24 | |
MESHID:D058186 | Acute Kidney Injury | 0.0405877 | 25 | |
MESHID:D004890 | Erythema | 0.0404266 | 26 | |
MESHID:D014202 | Tremor | 0.0398142 | 27 | |
MESHID:D000707 | Anaphylaxis | 0.0388938 | 28 | |
MESHID:D009203 | Myocardial Infarction | 0.0385734 | 29 | |
MESHID:D003221 | Confusion | 0.0385536 | 30 | |
MESHID:D007319 | Sleep Initiation and Maintenance Disorders | 0.0385167 | 31 | |
MESHID:D007239 | Infection | 0.0382705 | 32 | |
MESHID:D001247 | Asthenia | 0.0375889 | 33 | |
MESHID:D013921 | Thrombocytopenia | 0.0360778 | 34 | |
MESHID:D002637 | Chest Pain | 0.0358452 | 35 | |
MESHID:D003248 | Constipation | 0.0351535 | 36 | |
MESHID:D051437 | Renal Insufficiency | 0.0342263 | 37 | |
MESHID:D012131 | Respiratory Insufficiency | 0.0331871 | 38 | |
MESHID:D006323 | Heart Arrest | 0.0327931 | 39 | |
MESHID:D003967 | Diarrhea | 0.032543 | 40 | |
MESHID:D006333 | Heart Failure | 0.03241 | 41 | |
MESHID:D000799 | Angioedema | 0.0323272 | 42 | |
MESHID:D005483 | Flushing | 0.032076 | 43 | |
MESHID:D009336 | Necrosis | 0.0316069 | 44 | |
MESHID:D003371 | Cough | 0.0314288 | 45 | |
UMLSID:C0030252 | palpitation | 0.0313634 | 46 | |
MESHID:D001416 | Back Pain | 0.03135 | 47 | |
MESHID:D004362 | Drug Toxicity | 0.0306167 | 48 | |
UMLSID:C0085631 | agitated | 0.0305972 | 49 | |
MESHID:D006505 | Hepatitis | 0.0292252 | 50 |
Job Information
Job ID | Submitted date | Prediction type | Method | Network | Molecular fingerprint | Other parameter(s) | Score matrix |
---|---|---|---|---|---|---|---|
1665 | 2021-07-23 08:49:48 | Adverse drug events (ADEs) | ADENet | Global drug-ADE association network (version 2013) | Klekota-Roth (KR) | k = 2, Top 50 |