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| Stem definition | Drug id | CAS RN |
|---|---|---|
| 603 | 80-77-3 |
| Dose | Unit | Route |
|---|---|---|
| 0.60 | g | O |
| Property | Value | Reference |
|---|---|---|
| BDDCS (Biopharmaceutical Drug Disposition Classification System) | 1 | Hosey CM, Chan R, Benet LZ |
| BA (Bioavailability) | 99 % | Kim MT, Sedykh A, Chakravarti SK, Saiakhov RD, Zhu H |
| S (Water solubility) | 2.50 mg/mL | Bocci G, Oprea TI, Benet LZ |
| Property | Description | Value | Unit | Confidence | Similarity |
|---|---|---|---|---|---|
| pfas-class | PFAS structural alert (1 = True, 0 = False) | 0 |
| Date | Agency | Company | Orphan |
|---|---|---|---|
| May 20, 1960 | FDA |
| 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 |
|---|---|---|---|---|---|---|
| Food allergy | 1319.08 | 197.14 | 351 | 10632 | 25127 | 90592337 |
| Immunodeficiency | 1161.02 | 197.14 | 357 | 10626 | 42877 | 90574587 |
| Temperature regulation disorder | 1113.22 | 197.14 | 274 | 10709 | 14305 | 90603159 |
| Rash erythematous | 862.35 | 197.14 | 316 | 10667 | 64788 | 90552676 |
| Hyperhidrosis | 762.01 | 197.14 | 357 | 10626 | 135948 | 90481516 |
| Coeliac disease | 682.09 | 197.14 | 241 | 10742 | 44369 | 90573095 |
| Upper respiratory tract infection | 667.57 | 197.14 | 320 | 10663 | 127998 | 90489466 |
| Prescribed overdose | 656.37 | 197.14 | 291 | 10692 | 97334 | 90520130 |
| Fluid retention | 642.15 | 197.14 | 278 | 10705 | 87813 | 90529651 |
| Foetal death | 610.14 | 197.14 | 184 | 10799 | 20539 | 90596925 |
| Intentional product misuse | 592.22 | 197.14 | 264 | 10719 | 89340 | 90528124 |
| Overdose | 504.75 | 197.14 | 284 | 10699 | 157425 | 90460039 |
| Asthma | 472.94 | 197.14 | 318 | 10665 | 241842 | 90375622 |
| Exposure during pregnancy | 458.16 | 197.14 | 310 | 10673 | 238100 | 90379364 |
| Hepatic enzyme increased | 436.70 | 197.14 | 355 | 10628 | 360381 | 90257083 |
| Bursitis | 428.87 | 197.14 | 240 | 10743 | 131414 | 90486050 |
| Hypersensitivity | 358.06 | 197.14 | 351 | 10632 | 454326 | 90163138 |
| Product use issue | 329.49 | 197.14 | 291 | 10692 | 329628 | 90287836 |
| Thrombocytopenia | 325.15 | 197.14 | 239 | 10744 | 208486 | 90408978 |
| Erythema | 296.53 | 197.14 | 235 | 10748 | 229011 | 90388453 |
| Psoriasis | 294.80 | 197.14 | 197 | 10786 | 147557 | 90469907 |
| Constipation | 263.13 | 197.14 | 239 | 10744 | 280156 | 90337308 |
| Infusion related reaction | 262.95 | 197.14 | 286 | 10697 | 416494 | 90200970 |
| Back pain | 238.04 | 197.14 | 239 | 10744 | 316936 | 90300528 |
| Hypertension | 231.19 | 197.14 | 280 | 10703 | 457252 | 90160212 |
| Contraindicated product administered | 218.02 | 197.14 | 229 | 10754 | 319910 | 90297554 |
| Joint swelling | 199.21 | 197.14 | 273 | 10710 | 503027 | 90114437 |
| 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 |
|---|---|---|---|---|---|---|
| Post procedural infection | 62.21 | 57.81 | 11 | 99 | 5774 | 42615451 |
| 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 |
|---|---|---|---|---|---|---|
| Temperature regulation disorder | 1090.11 | 198.25 | 240 | 8020 | 12586 | 110568453 |
| Food allergy | 1005.11 | 198.25 | 244 | 8016 | 19704 | 110561335 |
| Immunodeficiency | 866.27 | 198.25 | 249 | 8011 | 38589 | 110542450 |
| Coeliac disease | 783.61 | 198.25 | 236 | 8024 | 42951 | 110538088 |
| Rash erythematous | 631.91 | 198.25 | 235 | 8025 | 81597 | 110499442 |
| Fluid retention | 631.46 | 198.25 | 244 | 8016 | 94063 | 110486976 |
| Foetal death | 581.84 | 198.25 | 151 | 8109 | 15894 | 110565145 |
| Upper respiratory tract infection | 533.97 | 198.25 | 238 | 8022 | 131090 | 110449949 |
| Bursitis | 526.77 | 198.25 | 235 | 8025 | 129683 | 110451356 |
| Hyperhidrosis | 485.28 | 198.25 | 249 | 8011 | 187049 | 110393990 |
| Prescribed overdose | 421.71 | 198.25 | 179 | 8081 | 87402 | 110493637 |
| Asthma | 383.99 | 198.25 | 236 | 8024 | 250055 | 110330984 |
| Hepatic enzyme increased | 356.19 | 198.25 | 247 | 8013 | 320645 | 110260394 |
| Erythema | 339.06 | 198.25 | 231 | 8029 | 291216 | 110289823 |
| Constipation | 303.08 | 198.25 | 234 | 8026 | 357552 | 110223487 |
| Psoriasis | 299.33 | 198.25 | 164 | 8096 | 139829 | 110441210 |
| Hypersensitivity | 298.98 | 198.25 | 244 | 8016 | 403754 | 110177285 |
| Back pain | 295.56 | 198.25 | 234 | 8026 | 370762 | 110210277 |
| Contraindicated product administered | 291.41 | 198.25 | 198 | 8062 | 248069 | 110332970 |
| Intentional product misuse | 282.18 | 198.25 | 155 | 8105 | 132749 | 110448290 |
| Drug hypersensitivity | 246.53 | 198.25 | 230 | 8030 | 453860 | 110127179 |
| Overdose | 242.67 | 198.25 | 173 | 8087 | 233621 | 110347418 |
| Rheumatoid arthritis | 206.65 | 198.25 | 174 | 8086 | 299439 | 110281600 |
| Product use issue | 202.69 | 198.25 | 175 | 8085 | 311520 | 110269519 |
None
| Source | Code | Description |
|---|---|---|
| ATC | M03BB02 | MUSCULO-SKELETAL SYSTEM MUSCLE RELAXANTS MUSCLE RELAXANTS, CENTRALLY ACTING AGENTS Oxazol, thiazine, and triazine derivatives |
| ATC | M03BB52 | MUSCULO-SKELETAL SYSTEM MUSCLE RELAXANTS MUSCLE RELAXANTS, CENTRALLY ACTING AGENTS Oxazol, thiazine, and triazine derivatives |
| ATC | M03BB72 | MUSCULO-SKELETAL SYSTEM MUSCLE RELAXANTS MUSCLE RELAXANTS, CENTRALLY ACTING AGENTS Oxazol, thiazine, and triazine derivatives |
| CHEBI has role | CHEBI:35474 | anxiolytic drug |
| CHEBI has role | CHEBI:35476 | antipsychotic agent |
| CHEBI has role | CHEBI:51371 | muscle relaxant |
| MeSH PA | D002492 | Central Nervous System Depressants |
| MeSH PA | D009125 | Muscle Relaxants, Central |
| MeSH PA | D009465 | Neuromuscular Agents |
| MeSH PA | D011619 | Psychotropic Drugs |
| MeSH PA | D014151 | Anti-Anxiety Agents |
| Disease | Relation | SNOMED_ID | DOID |
|---|---|---|---|
| Anxiety | indication | 48694002 |
None
None
None
None
None
None
| ID | Source |
|---|---|
| 4018260 | VUID |
| N0000146590 | NUI |
| D00268 | KEGG_DRUG |
| 2373 | RXNORM |
| C0008223 | UMLSCUI |
| CHEBI:3619 | CHEBI |
| CHEMBL1200714 | ChEMBL_ID |
| DB01178 | DRUGBANK_ID |
| D002720 | MESH_DESCRIPTOR_UI |
| 2717 | PUBCHEM_CID |
| 7323 | IUPHAR_LIGAND_ID |
| 782 | INN_ID |
| GP568V9G19 | UNII |
| 4413 | MMSL |
| d00909 | MMSL |
| 001447 | NDDF |
| 387400008 | SNOMEDCT_US |
| 71634000 | SNOMEDCT_US |
| 4018260 | VANDF |
None