| Stem definition | Drug id | CAS RN |
|---|---|---|
| 2153 | 108-73-6 |
None
None
None
| MedDRA adverse event term | Likelihood ratio | Likelihood ratio threshold | Patients taking drug having adverse event | Patients taking drug not having adverse event | Patients not taking drug having adverse event | Patients not taking drug not having adverse event |
|---|---|---|---|---|---|---|
| Drug reaction with eosinophilia and systemic symptoms | 113.39 | 36.50 | 44 | 2353 | 33792 | 63452833 |
| Hepatocellular injury | 107.58 | 36.50 | 40 | 2357 | 27341 | 63459284 |
| Acute kidney injury | 58.31 | 36.50 | 60 | 2337 | 263355 | 63223270 |
| Cell death | 55.58 | 36.50 | 14 | 2383 | 2587 | 63484038 |
| Hyponatraemia | 54.41 | 36.50 | 40 | 2357 | 111860 | 63374765 |
| Cholestasis | 54.07 | 36.50 | 25 | 2372 | 29409 | 63457216 |
| Thrombocytopenia | 45.82 | 36.50 | 41 | 2356 | 151116 | 63335509 |
| Febrile bone marrow aplasia | 41.26 | 36.50 | 14 | 2383 | 7311 | 63479314 |
| Poisoning deliberate | 38.98 | 36.50 | 15 | 2382 | 11203 | 63475422 |
| Hepatosplenic candidiasis | 38.72 | 36.50 | 7 | 2390 | 264 | 63486361 |
| MedDRA adverse event term | Likelihood ratio | Likelihood ratio threshold | Patients taking drug having adverse event | Patients taking drug not having adverse event | Patients not taking drug having adverse event | Patients not taking drug not having adverse event |
|---|---|---|---|---|---|---|
| Hyperleukocytosis | 65.57 | 30.53 | 16 | 1709 | 1986 | 34953220 |
| Urethral valves | 62.29 | 30.53 | 11 | 1714 | 275 | 34954931 |
| Pancreatitis acute | 60.74 | 30.53 | 29 | 1696 | 28112 | 34927094 |
| Febrile bone marrow aplasia | 47.01 | 30.53 | 17 | 1708 | 8192 | 34947014 |
| Acute kidney injury | 41.48 | 30.53 | 62 | 1663 | 304926 | 34650280 |
| Puncture site haematoma | 40.67 | 30.53 | 7 | 1718 | 150 | 34955056 |
| Bicytopenia | 39.07 | 30.53 | 11 | 1714 | 2373 | 34952833 |
| Diarrhoea infectious | 36.88 | 30.53 | 8 | 1717 | 589 | 34954617 |
| Tuberculosis | 35.46 | 30.53 | 14 | 1711 | 8563 | 34946643 |
| Eosinophilia | 30.76 | 30.53 | 18 | 1707 | 26204 | 34929002 |
| MedDRA adverse event term | Likelihood ratio | Likelihood ratio threshold | Patients taking drug having adverse event | Patients taking drug not having adverse event | Patients not taking drug having adverse event | Patients not taking drug not having adverse event |
|---|---|---|---|---|---|---|
| Hepatocellular injury | 119.08 | 29.26 | 55 | 4037 | 47538 | 79692758 |
| Drug reaction with eosinophilia and systemic symptoms | 111.98 | 29.26 | 58 | 4034 | 64186 | 79676110 |
| Acute kidney injury | 91.36 | 29.26 | 122 | 3970 | 519282 | 79221014 |
| Pancreatitis acute | 84.15 | 29.26 | 44 | 4048 | 49560 | 79690736 |
| Febrile bone marrow aplasia | 77.35 | 29.26 | 28 | 4064 | 12992 | 79727304 |
| Cholestasis | 68.36 | 29.26 | 39 | 4053 | 52070 | 79688226 |
| Hyperleukocytosis | 65.51 | 29.26 | 17 | 4075 | 2593 | 79737703 |
| Thrombocytopenia | 55.36 | 29.26 | 68 | 4024 | 265191 | 79475105 |
| Cell death | 51.39 | 29.26 | 16 | 4076 | 4683 | 79735613 |
| Toxic skin eruption | 50.25 | 29.26 | 24 | 4068 | 22269 | 79718027 |
| Eosinophilia | 41.59 | 29.26 | 27 | 4065 | 45318 | 79694978 |
| Abdominal pain | 40.59 | 29.26 | 72 | 4020 | 389497 | 79350799 |
| Puncture site haematoma | 39.24 | 29.26 | 7 | 4085 | 178 | 79740118 |
| Hypokalaemia | 38.51 | 29.26 | 42 | 4050 | 143998 | 79596298 |
| Drug ineffective | 36.42 | 29.26 | 6 | 4086 | 1080907 | 78659389 |
| Hyponatraemia | 36.08 | 29.26 | 45 | 4047 | 177803 | 79562493 |
| Hepatic cytolysis | 34.72 | 29.26 | 20 | 4072 | 27131 | 79713165 |
| Wrong product administered | 34.23 | 29.26 | 14 | 4078 | 8998 | 79731298 |
| Acute generalised exanthematous pustulosis | 34.15 | 29.26 | 17 | 4075 | 17237 | 79723059 |
| Neutropenia | 33.63 | 29.26 | 56 | 4036 | 287654 | 79452642 |
| Poisoning deliberate | 32.75 | 29.26 | 17 | 4075 | 18811 | 79721485 |
| Gamma-glutamyltransferase increased | 32.55 | 29.26 | 25 | 4067 | 54655 | 79685641 |
| Porphyria | 32.01 | 29.26 | 6 | 4086 | 202 | 79740094 |
| Fatigue | 31.65 | 29.26 | 5 | 4087 | 929722 | 78810574 |
| Bicytopenia | 31.35 | 29.26 | 11 | 4081 | 4659 | 79735637 |
| Hepatosplenic candidiasis | 31.16 | 29.26 | 7 | 4085 | 581 | 79739715 |
| Rash maculo-papular | 29.84 | 29.26 | 24 | 4068 | 56054 | 79684242 |
None
| Source | Code | Description |
|---|---|---|
| ATC | A03AX12 | ALIMENTARY TRACT AND METABOLISM DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS Other drugs for functional gastrointestinal disorders |
| MeSH PA | D007202 | Indicators and Reagents |
| CHEBI has role | CHEBI:84735 | algal metabolites |
None
None
None
| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 8.35 | acidic |
| pKa2 | 10.35 | acidic |
| pKa3 | 12.36 | acidic |
None
None
| Target | Class | Pharos | UniProt | Action | Type | Activity value (-log[M]) | Mechanism action | Bioact source | MoA source |
|---|---|---|---|---|---|---|---|---|---|
| Beta-secretase 1 | Enzyme | IC50 | 4.44 | CHEMBL |
| ID | Source |
|---|---|
| N0000166595 | NUI |
| D00152 | KEGG_DRUG |
| C0031566 | UMLSCUI |
| CHEBI:16204 | CHEBI |
| 13X | PDB_CHEM_ID |
| CHEMBL473159 | ChEMBL_ID |
| 359 | PUBCHEM_CID |
| DB12944 | DRUGBANK_ID |
| D010696 | MESH_DESCRIPTOR_UI |
| DHD7FFG6YS | UNII |
| 8196 | RXNORM |
| 005931 | NDDF |
| 19341000122103 | SNOMEDCT_US |
None