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| Stem definition | Drug id | CAS RN |
|---|---|---|
| anorexics | 195 | 300-62-9 |
| Dose | Unit | Route |
|---|---|---|
| 15 | mg | O |
| 15 | mg | P |
| Property | Value | Reference |
|---|---|---|
| BDDCS (Biopharmaceutical Drug Disposition Classification System) | 0 | Benet LZ, Broccatelli F, Oprea TI |
| S (Water solubility) | 30 mg/mL | Benet LZ, Broccatelli F, Oprea TI |
| EoM (Fraction excreted unchanged in urine) | 40 % | Benet LZ, Broccatelli F, Oprea TI |
| MRTD (Maximum Recommended Therapeutic Daily Dose) | 7.40 ยตM/kg/day | Contrera JF, Matthews EJ, Kruhlak NL, Benz RD |
| Vd (Volume of distribution) | 6.10 L/kg | Lombardo F, Berellini G, Obach RS |
| CL (Clearance) | 9.70 mL/min/kg | Lombardo F, Berellini G, Obach RS |
| fu (Fraction unbound in plasma) | 0.80 % | Lombardo F, Berellini G, Obach RS |
| t_half (Half-life) | 7.30 hours | Lombardo F, Berellini G, Obach RS |
| Property | Description | Value | Unit | Confidence | Similarity |
|---|---|---|---|---|---|
| kinase-safety-class | ACVR2A,ACVR2B,AKT1,AKT2,AKT3,AXL,BRAF,BTK,CAMK2B,CAMK2D,CDK5,CDK9,DDR1,DYRK1B,EIF2AK3,EPHB4,ERBB2,FLT3,GRK2,ITK,JAK2,JAK3,MAP2K6,MAP3K21,MAP3K7,MAPK12,MAPK7,MET,NTRK2,PDK2,PDK4,PIM2,PRKCD,PRKDC,SIK2,SIK3,STK33,SYK,TEK,TGFBR1 | 40 | |||
| kinase-selectivity-class | AKT2,AKT3,AXL,FLT3,GRK2,PDK4,PRKCD,SIK2 | 8 | |||
| pfas-class | PFAS structural alert (1 = True, 0 = False) | 0 |
| Date | Agency | Company | Orphan |
|---|---|---|---|
| Sept. 9, 1955 | FDA | UCB INC |
| 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 |
|---|---|---|---|---|---|---|
| Toxicity to various agents | 1562.72 | 20.42 | 690 | 8280 | 287156 | 90332321 |
| Completed suicide | 1171.01 | 20.42 | 463 | 8507 | 144595 | 90474882 |
| Drug abuse | 1142.79 | 20.42 | 392 | 8578 | 81955 | 90537522 |
| Cardio-respiratory arrest | 426.08 | 20.42 | 178 | 8792 | 62962 | 90556515 |
| Respiratory arrest | 329.90 | 20.42 | 124 | 8846 | 33187 | 90586290 |
| Cardiac arrest | 311.41 | 20.42 | 168 | 8802 | 104767 | 90514710 |
| Overdose | 168.33 | 20.42 | 133 | 8837 | 157576 | 90461901 |
| Poisoning | 162.79 | 20.42 | 60 | 8910 | 15157 | 90604320 |
| Coronary artery dissection | 109.04 | 20.42 | 24 | 8946 | 930 | 90618547 |
| Substance abuse | 79.45 | 20.42 | 27 | 8943 | 5379 | 90614098 |
| Renal infarct | 76.77 | 20.42 | 20 | 8950 | 1595 | 90617882 |
| Exposure via ingestion | 75.60 | 20.42 | 22 | 8948 | 2645 | 90616832 |
| Intentional overdose | 74.87 | 20.42 | 67 | 8903 | 93767 | 90525710 |
| Death | 74.57 | 20.42 | 149 | 8821 | 456402 | 90163075 |
| Agitation | 70.17 | 20.42 | 56 | 8914 | 67042 | 90552435 |
| Suspected suicide | 64.44 | 20.42 | 27 | 8943 | 9541 | 90609936 |
| Miosis | 51.54 | 20.42 | 23 | 8947 | 9461 | 90610016 |
| Unresponsive to stimuli | 46.79 | 20.42 | 35 | 8935 | 38086 | 90581391 |
| Intestinal infarction | 44.91 | 20.42 | 12 | 8958 | 1055 | 90618422 |
| Intentional product misuse | 42.01 | 20.42 | 48 | 8922 | 89556 | 90529921 |
| Drug screen positive | 40.84 | 20.42 | 15 | 8955 | 3742 | 90615735 |
| Tachycardia | 40.65 | 20.42 | 63 | 8907 | 157610 | 90461867 |
| Serotonin syndrome | 40.40 | 20.42 | 32 | 8938 | 37855 | 90581622 |
| Accidental overdose | 39.32 | 20.42 | 28 | 8942 | 28245 | 90591232 |
| Brain oedema | 35.81 | 20.42 | 22 | 8948 | 17363 | 90602114 |
| Somnolence | 34.92 | 20.42 | 69 | 8901 | 209015 | 90410462 |
| Drug dependence | 33.94 | 20.42 | 26 | 8944 | 29301 | 90590176 |
| Mydriasis | 33.50 | 20.42 | 20 | 8950 | 14992 | 90604485 |
| Metabolic acidosis | 33.43 | 20.42 | 34 | 8936 | 55642 | 90563835 |
| Product substitution issue | 32.60 | 20.42 | 21 | 8949 | 17987 | 90601490 |
| Drug intolerance | 30.77 | 20.42 | 4 | 8966 | 447587 | 90171890 |
| Suicide attempt | 29.75 | 20.42 | 37 | 8933 | 75362 | 90544115 |
| Brachial artery entrapment syndrome | 29.60 | 20.42 | 5 | 8965 | 45 | 90619432 |
| Infusion related reaction | 28.00 | 20.42 | 4 | 8966 | 416776 | 90202701 |
| Anterograde amnesia | 26.35 | 20.42 | 7 | 8963 | 602 | 90618875 |
| Product administration interrupted | 26.22 | 20.42 | 16 | 8954 | 12476 | 90607001 |
| Depressed level of consciousness | 26.00 | 20.42 | 34 | 8936 | 72750 | 90546727 |
| Diarrhoea | 25.98 | 20.42 | 33 | 8937 | 939157 | 89680320 |
| Substance use disorder | 25.47 | 20.42 | 9 | 8961 | 2011 | 90617466 |
| Systemic lupus erythematosus | 25.44 | 20.42 | 3 | 8967 | 361893 | 90257584 |
| Physical abuse | 25.10 | 20.42 | 4 | 8966 | 24 | 90619453 |
| Hepatic necrosis | 23.87 | 20.42 | 12 | 8958 | 6426 | 90613051 |
| Respiratory depression | 22.99 | 20.42 | 16 | 8954 | 15559 | 90603918 |
| Locked-in syndrome | 22.93 | 20.42 | 6 | 8964 | 486 | 90618991 |
| Substance abuser | 22.76 | 20.42 | 5 | 8965 | 192 | 90619285 |
| Amphetamines positive | 22.30 | 20.42 | 5 | 8965 | 211 | 90619266 |
| Joint swelling | 22.28 | 20.42 | 11 | 8959 | 503289 | 90116188 |
| Poisoning deliberate | 22.17 | 20.42 | 16 | 8954 | 16470 | 90603007 |
| Electrocardiogram QT prolonged | 21.58 | 20.42 | 31 | 8939 | 72425 | 90547052 |
| Arthropathy | 21.40 | 20.42 | 5 | 8965 | 366237 | 90253240 |
| Cardiogenic shock | 20.54 | 20.42 | 18 | 8952 | 24450 | 90595027 |
| 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 |
|---|---|---|---|---|---|---|
| Toxicity to various agents | 3014.92 | 28.01 | 1338 | 9325 | 227798 | 42382874 |
| Drug abuse | 2356.57 | 28.01 | 903 | 9760 | 103868 | 42506804 |
| Completed suicide | 582.94 | 28.01 | 338 | 10325 | 96127 | 42514545 |
| Substance abuse | 373.29 | 28.01 | 123 | 10540 | 8782 | 42601890 |
| Respiratory arrest | 365.26 | 28.01 | 166 | 10497 | 28258 | 42582414 |
| Overdose | 277.25 | 28.01 | 221 | 10442 | 105043 | 42505629 |
| Cardio-respiratory arrest | 272.22 | 28.01 | 174 | 10489 | 58462 | 42552210 |
| Cardiac arrest | 230.70 | 28.01 | 202 | 10461 | 109118 | 42501554 |
| Intentional product misuse | 204.66 | 28.01 | 149 | 10514 | 61751 | 42548921 |
| Brain oedema | 186.58 | 28.01 | 88 | 10575 | 16239 | 42594433 |
| Poisoning | 176.54 | 28.01 | 82 | 10581 | 14617 | 42596055 |
| Aggression | 168.32 | 28.01 | 116 | 10547 | 44047 | 42566625 |
| Pulmonary oedema | 155.38 | 28.01 | 119 | 10544 | 53153 | 42557519 |
| Respiratory depression | 145.75 | 28.01 | 78 | 10585 | 18790 | 42591882 |
| Myelopathy | 141.69 | 28.01 | 45 | 10618 | 2846 | 42607826 |
| Drug dependence | 138.92 | 28.01 | 88 | 10575 | 29006 | 42581666 |
| Decreased eye contact | 117.06 | 28.01 | 27 | 10636 | 496 | 42610176 |
| Oppositional defiant disorder | 114.66 | 28.01 | 27 | 10636 | 545 | 42610127 |
| Bruxism | 99.06 | 28.01 | 32 | 10631 | 2137 | 42608535 |
| Substance use disorder | 83.94 | 28.01 | 36 | 10627 | 5309 | 42605363 |
| Drug use disorder | 83.38 | 28.01 | 44 | 10619 | 10289 | 42600383 |
| Homicidal ideation | 79.77 | 28.01 | 29 | 10634 | 2765 | 42607907 |
| Rhabdomyolysis | 75.13 | 28.01 | 95 | 10568 | 77924 | 42532748 |
| Serotonin syndrome | 71.48 | 28.01 | 56 | 10607 | 25789 | 42584883 |
| Crying | 65.51 | 28.01 | 32 | 10631 | 6362 | 42604310 |
| Compartment syndrome | 64.63 | 28.01 | 26 | 10637 | 3263 | 42607409 |
| Abnormal behaviour | 59.86 | 28.01 | 51 | 10612 | 26400 | 42584272 |
| Internal injury | 58.02 | 28.01 | 9 | 10654 | 12 | 42610660 |
| Choreoathetosis | 57.40 | 28.01 | 18 | 10645 | 1091 | 42609581 |
| Diarrhoea | 57.27 | 28.01 | 22 | 10641 | 460827 | 42149845 |
| Trismus | 53.93 | 28.01 | 22 | 10641 | 2862 | 42607810 |
| Exposure via ingestion | 53.13 | 28.01 | 20 | 10643 | 2102 | 42608570 |
| Substance use | 53.08 | 28.01 | 19 | 10644 | 1732 | 42608940 |
| Dyskinesia | 51.50 | 28.01 | 46 | 10617 | 25344 | 42585328 |
| Accidental poisoning | 50.65 | 28.01 | 17 | 10646 | 1279 | 42609393 |
| Miosis | 50.39 | 28.01 | 35 | 10628 | 13411 | 42597261 |
| Drug interaction | 49.65 | 28.01 | 163 | 10500 | 266836 | 42343836 |
| Unresponsive to stimuli | 48.63 | 28.01 | 49 | 10614 | 31354 | 42579318 |
| Pulmonary congestion | 47.67 | 28.01 | 36 | 10627 | 15694 | 42594978 |
| Quadriparesis | 47.64 | 28.01 | 19 | 10644 | 2331 | 42608341 |
| Dyspnoea | 47.40 | 28.01 | 26 | 10637 | 442595 | 42168077 |
| Pyrexia | 46.97 | 28.01 | 20 | 10643 | 394022 | 42216650 |
| Accidental overdose | 45.33 | 28.01 | 45 | 10618 | 28285 | 42582387 |
| Withdrawal syndrome | 45.19 | 28.01 | 34 | 10629 | 14741 | 42595931 |
| Coordination abnormal | 45.13 | 28.01 | 27 | 10636 | 8023 | 42602649 |
| Anaemia | 44.94 | 28.01 | 8 | 10655 | 280270 | 42330402 |
| Psychomotor hyperactivity | 44.56 | 28.01 | 30 | 10633 | 10928 | 42599744 |
| Intentional overdose | 43.79 | 28.01 | 59 | 10604 | 51397 | 42559275 |
| Spinal shock | 43.70 | 28.01 | 8 | 10655 | 42 | 42610630 |
| Hyperkinesia | 42.66 | 28.01 | 17 | 10646 | 2081 | 42608591 |
| Pneumonia | 42.08 | 28.01 | 27 | 10636 | 422122 | 42188550 |
| Suicidal ideation | 39.13 | 28.01 | 54 | 10609 | 48107 | 42562565 |
| Bladder dilatation | 38.97 | 28.01 | 15 | 10648 | 1675 | 42608997 |
| Vertebral artery dissection | 38.69 | 28.01 | 7 | 10656 | 34 | 42610638 |
| Irritability | 38.35 | 28.01 | 41 | 10622 | 28087 | 42582585 |
| Prescription drug used without a prescription | 38.34 | 28.01 | 17 | 10646 | 2713 | 42607959 |
| Affect lability | 37.75 | 28.01 | 19 | 10644 | 4025 | 42606647 |
| Poor quality sleep | 36.37 | 28.01 | 25 | 10638 | 9415 | 42601257 |
| Off label use | 35.80 | 28.01 | 66 | 10597 | 638269 | 41972403 |
| Mood altered | 35.77 | 28.01 | 26 | 10637 | 10692 | 42599980 |
| Mydriasis | 35.63 | 28.01 | 24 | 10639 | 8746 | 42601926 |
| Streptococcal infection | 35.50 | 28.01 | 21 | 10642 | 6111 | 42604561 |
| Stress cardiomyopathy | 34.85 | 28.01 | 16 | 10647 | 2769 | 42607903 |
| Counterfeit product administered | 34.34 | 28.01 | 9 | 10654 | 285 | 42610387 |
| Thrombocytopenia | 33.79 | 28.01 | 4 | 10659 | 190275 | 42420397 |
| Drug screen positive | 31.65 | 28.01 | 17 | 10646 | 4114 | 42606558 |
| Rash | 31.47 | 28.01 | 15 | 10648 | 276939 | 42333733 |
| Impaired driving ability | 30.90 | 28.01 | 15 | 10648 | 2940 | 42607732 |
| Sepsis | 29.21 | 28.01 | 7 | 10656 | 199327 | 42411345 |
| Cluster headache | 28.58 | 28.01 | 9 | 10654 | 553 | 42610119 |
| 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 |
|---|---|---|---|---|---|---|
| Toxicity to various agents | 4471.06 | 21.97 | 1925 | 15594 | 478630 | 110093150 |
| Drug abuse | 3546.20 | 21.97 | 1245 | 16274 | 176166 | 110395614 |
| Completed suicide | 1672.23 | 21.97 | 796 | 16723 | 241585 | 110330195 |
| Respiratory arrest | 731.49 | 21.97 | 293 | 17226 | 58006 | 110513774 |
| Cardio-respiratory arrest | 715.31 | 21.97 | 354 | 17165 | 115482 | 110456298 |
| Cardiac arrest | 569.93 | 21.97 | 366 | 17153 | 196387 | 110375393 |
| Overdose | 437.90 | 21.97 | 333 | 17186 | 233461 | 110338319 |
| Substance abuse | 395.92 | 21.97 | 125 | 17394 | 12338 | 110559442 |
| Poisoning | 342.99 | 21.97 | 140 | 17379 | 28965 | 110542815 |
| Intentional product misuse | 236.70 | 21.97 | 184 | 17335 | 132720 | 110439060 |
| Brain oedema | 206.24 | 21.97 | 100 | 17419 | 30998 | 110540782 |
| Aggression | 203.31 | 21.97 | 123 | 17396 | 59087 | 110512693 |
| Respiratory depression | 182.86 | 21.97 | 93 | 17426 | 31908 | 110539872 |
| Drug dependence | 164.24 | 21.97 | 101 | 17418 | 49919 | 110521861 |
| Pulmonary oedema | 150.75 | 21.97 | 126 | 17393 | 100533 | 110471247 |
| Death | 132.70 | 21.97 | 321 | 17198 | 698548 | 109873232 |
| Oppositional defiant disorder | 129.60 | 21.97 | 27 | 17492 | 491 | 110571289 |
| Exposure via ingestion | 126.45 | 21.97 | 42 | 17477 | 4858 | 110566922 |
| Accidental overdose | 122.04 | 21.97 | 85 | 17434 | 51749 | 110520031 |
| Coronary artery dissection | 120.89 | 21.97 | 30 | 17489 | 1218 | 110570562 |
| Serotonin syndrome | 118.65 | 21.97 | 88 | 17431 | 59065 | 110512715 |
| Substance use disorder | 117.38 | 21.97 | 44 | 17475 | 7246 | 110564534 |
| Decreased eye contact | 114.30 | 21.97 | 27 | 17492 | 888 | 110570892 |
| Intentional overdose | 105.27 | 21.97 | 117 | 17402 | 132384 | 110439396 |
| Drug use disorder | 104.61 | 21.97 | 53 | 17466 | 18021 | 110553759 |
| Miosis | 103.11 | 21.97 | 56 | 17463 | 21927 | 110549853 |
| Unresponsive to stimuli | 99.93 | 21.97 | 82 | 17437 | 63708 | 110508072 |
| Bruxism | 90.94 | 21.97 | 33 | 17486 | 4961 | 110566819 |
| Homicidal ideation | 81.41 | 21.97 | 28 | 17491 | 3599 | 110568181 |
| Agitation | 79.93 | 21.97 | 94 | 17425 | 112957 | 110458823 |
| Abnormal behaviour | 78.09 | 21.97 | 58 | 17461 | 38981 | 110532799 |
| Diarrhoea | 76.37 | 21.97 | 43 | 17476 | 1139462 | 109432318 |
| Suspected suicide | 74.86 | 21.97 | 40 | 17479 | 15159 | 110556621 |
| Drug screen positive | 69.25 | 21.97 | 29 | 17490 | 6381 | 110565399 |
| Pulmonary congestion | 66.44 | 21.97 | 48 | 17471 | 30918 | 110540862 |
| Mydriasis | 65.80 | 21.97 | 42 | 17477 | 22115 | 110549665 |
| Off label use | 57.06 | 21.97 | 94 | 17425 | 1500091 | 109071689 |
| Dyskinesia | 56.32 | 21.97 | 54 | 17465 | 51392 | 110520388 |
| Renal infarct | 52.87 | 21.97 | 20 | 17499 | 3375 | 110568405 |
| Drug interaction | 51.42 | 21.97 | 185 | 17334 | 499998 | 110071782 |
| Dyspnoea | 51.38 | 21.97 | 60 | 17459 | 1106812 | 109464968 |
| Rhabdomyolysis | 51.03 | 21.97 | 78 | 17441 | 120323 | 110451457 |
| Pyrexia | 50.58 | 21.97 | 41 | 17478 | 898224 | 109673556 |
| Suicidal ideation | 50.28 | 21.97 | 68 | 17451 | 93869 | 110477911 |
| Choreoathetosis | 49.65 | 21.97 | 16 | 17503 | 1682 | 110570098 |
| Drug intolerance | 49.39 | 21.97 | 4 | 17515 | 406508 | 110165272 |
| Amphetamines positive | 48.83 | 21.97 | 11 | 17508 | 292 | 110571488 |
| Irritability | 48.25 | 21.97 | 48 | 17471 | 47761 | 110524019 |
| Accidental poisoning | 47.40 | 21.97 | 17 | 17502 | 2470 | 110569310 |
| Anaemia | 47.30 | 21.97 | 14 | 17505 | 547072 | 110024708 |
| Substance use | 47.28 | 21.97 | 17 | 17502 | 2489 | 110569291 |
| Psychomotor hyperactivity | 47.11 | 21.97 | 33 | 17486 | 20244 | 110551536 |
| Internal injury | 46.50 | 21.97 | 11 | 17508 | 364 | 110571416 |
| Physical abuse | 46.45 | 21.97 | 8 | 17511 | 48 | 110571732 |
| Trismus | 46.09 | 21.97 | 22 | 17497 | 6574 | 110565206 |
| Pneumonia | 44.57 | 21.97 | 44 | 17475 | 876670 | 109695110 |
| Withdrawal syndrome | 44.29 | 21.97 | 38 | 17481 | 31342 | 110540438 |
| Hyperkinesia | 43.31 | 21.97 | 17 | 17502 | 3167 | 110568613 |
| Joint swelling | 40.78 | 21.97 | 10 | 17509 | 442835 | 110128945 |
| Infusion related reaction | 40.61 | 21.97 | 6 | 17513 | 381156 | 110190624 |
| Tachycardia | 40.53 | 21.97 | 102 | 17417 | 226543 | 110345237 |
| Prescription drug used without a prescription | 40.46 | 21.97 | 19 | 17500 | 5477 | 110566303 |
| Compartment syndrome | 39.14 | 21.97 | 19 | 17500 | 5891 | 110565889 |
| Arthralgia | 38.61 | 21.97 | 40 | 17479 | 779592 | 109792188 |
| Cardiogenic shock | 37.74 | 21.97 | 46 | 17473 | 57292 | 110514488 |
| Malaise | 37.35 | 21.97 | 31 | 17488 | 671788 | 109899992 |
| Hepatic enzyme increased | 36.73 | 21.97 | 4 | 17515 | 320888 | 110250892 |
| Crying | 36.10 | 21.97 | 31 | 17488 | 25597 | 110546183 |
| Intestinal infarction | 35.87 | 21.97 | 12 | 17507 | 1418 | 110570362 |
| Streptococcal infection | 35.74 | 21.97 | 22 | 17497 | 10868 | 110560912 |
| Suicide attempt | 35.64 | 21.97 | 61 | 17458 | 103333 | 110468447 |
| Rash | 35.42 | 21.97 | 47 | 17472 | 820917 | 109750863 |
| Stress cardiomyopathy | 35.04 | 21.97 | 25 | 17494 | 15781 | 110555999 |
| Pruritus | 34.65 | 21.97 | 25 | 17494 | 581535 | 109990245 |
| Arthropathy | 34.44 | 21.97 | 3 | 17516 | 287519 | 110284261 |
| Cyanosis | 34.04 | 21.97 | 32 | 17487 | 29709 | 110542071 |
| Counterfeit product administered | 33.69 | 21.97 | 8 | 17511 | 269 | 110571511 |
| Coordination abnormal | 32.49 | 21.97 | 29 | 17490 | 25199 | 110546581 |
| Mood altered | 32.46 | 21.97 | 27 | 17492 | 21348 | 110550432 |
| Impaired driving ability | 32.03 | 21.97 | 17 | 17502 | 6353 | 110565427 |
| Thrombocytopenia | 31.87 | 21.97 | 8 | 17511 | 348877 | 110222903 |
| Vomiting | 31.83 | 21.97 | 60 | 17459 | 910615 | 109661165 |
| Pain | 31.59 | 21.97 | 65 | 17454 | 954890 | 109616890 |
| Asthenia | 31.20 | 21.97 | 38 | 17481 | 688961 | 109882819 |
| Coma | 31.13 | 21.97 | 62 | 17457 | 117807 | 110453973 |
| Nasopharyngitis | 30.75 | 21.97 | 12 | 17507 | 394349 | 110177431 |
| Condition aggravated | 30.74 | 21.97 | 43 | 17476 | 734793 | 109836987 |
| Somnolence | 30.49 | 21.97 | 110 | 17409 | 297339 | 110274441 |
| Swelling | 30.28 | 21.97 | 9 | 17510 | 351032 | 110220748 |
| Alcohol abuse | 30.12 | 21.97 | 15 | 17504 | 4914 | 110566866 |
| Vertebral artery dissection | 30.00 | 21.97 | 7 | 17512 | 218 | 110571562 |
| General physical health deterioration | 29.92 | 21.97 | 15 | 17504 | 425280 | 110146500 |
| Nausea | 29.53 | 21.97 | 99 | 17420 | 1235591 | 109336189 |
| Drug hypersensitivity | 29.08 | 21.97 | 18 | 17501 | 454072 | 110117708 |
| Product substitution issue | 28.69 | 21.97 | 26 | 17493 | 23035 | 110548745 |
| Accident | 28.22 | 21.97 | 19 | 17500 | 10933 | 110560847 |
| Metabolic acidosis | 28.20 | 21.97 | 54 | 17465 | 99690 | 110472090 |
| Asphyxia | 28.15 | 21.97 | 21 | 17498 | 14194 | 110557586 |
| Treatment failure | 28.10 | 21.97 | 5 | 17514 | 277229 | 110294551 |
| Abdominal discomfort | 27.54 | 21.97 | 14 | 17505 | 393844 | 110177936 |
| Affect lability | 27.18 | 21.97 | 23 | 17496 | 18614 | 110553166 |
| Stomatitis | 27.12 | 21.97 | 5 | 17514 | 270237 | 110301543 |
| Contraindicated product administered | 26.22 | 21.97 | 4 | 17515 | 248263 | 110323517 |
| Depressed level of consciousness | 26.06 | 21.97 | 56 | 17463 | 112222 | 110459558 |
| Brachial artery entrapment syndrome | 26.02 | 21.97 | 5 | 17514 | 59 | 110571721 |
| Substance-induced psychotic disorder | 25.94 | 21.97 | 14 | 17505 | 5410 | 110566370 |
| Neuromuscular blockade | 25.86 | 21.97 | 8 | 17511 | 736 | 110571044 |
| Cluster headache | 25.86 | 21.97 | 9 | 17510 | 1198 | 110570582 |
| Paranoia | 25.46 | 21.97 | 24 | 17495 | 22350 | 110549430 |
| Drug ineffective | 25.20 | 21.97 | 140 | 17379 | 1520400 | 109051380 |
| Therapeutic product effect incomplete | 25.08 | 21.97 | 3 | 17516 | 223802 | 110347978 |
| Loss of consciousness | 24.89 | 21.97 | 78 | 17441 | 196228 | 110375552 |
| Drug diversion | 24.68 | 21.97 | 9 | 17510 | 1371 | 110570409 |
| Screaming | 24.47 | 21.97 | 13 | 17506 | 4868 | 110566912 |
| Pericarditis | 24.39 | 21.97 | 3 | 17516 | 219111 | 110352669 |
| Wound | 24.26 | 21.97 | 4 | 17515 | 234433 | 110337347 |
| C-reactive protein increased | 24.22 | 21.97 | 3 | 17516 | 217916 | 110353864 |
| Accidental death | 24.15 | 21.97 | 13 | 17506 | 4996 | 110566784 |
| Poisoning deliberate | 23.95 | 21.97 | 25 | 17494 | 26306 | 110545474 |
| Cough | 23.60 | 21.97 | 23 | 17496 | 461618 | 110110162 |
| Rheumatoid arthritis | 23.54 | 21.97 | 9 | 17510 | 299604 | 110272176 |
| Speech disorder | 23.46 | 21.97 | 38 | 17481 | 61531 | 110510249 |
| Postmortem blood drug level abnormal | 22.75 | 21.97 | 7 | 17512 | 633 | 110571147 |
| Hyperthermia | 22.66 | 21.97 | 22 | 17497 | 21250 | 110550530 |
| Peripheral swelling | 21.99 | 21.97 | 19 | 17500 | 404015 | 110167765 |
| Hypersensitivity | 21.98 | 21.97 | 19 | 17500 | 403979 | 110167801 |
None
| Source | Code | Description |
|---|---|---|
| ATC | N06BA01 | NERVOUS SYSTEM PSYCHOANALEPTICS PSYCHOSTIMULANTS, AGENTS USED FOR ADHD AND NOOTROPICS Centrally acting sympathomimetics |
| CHEBI has role | CHEBI:35523 | bronchodilator agent |
| CHEBI has role | CHEBI:35524 | sympathomimetic agent |
| CHEBI has role | CHEBI:35640 | adrenergic uptake inhibitor |
| CHEBI has role | CHEBI:35703 | xenobiotic |
| CHEBI has role | CHEBI:37962 | adrenergic agent |
| CHEBI has role | CHEBI:48560 | dopaminergic agent |
| CHEBI has role | CHEBI:50910 | neurotoxin |
| CHEBI has role | CHEBI:51039 | dopamine uptake inhibitor |
| CHEBI has role | CHEBI:78298 | environmental contaminant |
| MeSH PA | D000697 | Central Nervous System Stimulants |
| MeSH PA | D002491 | Central Nervous System Agents |
| MeSH PA | D013566 | Sympathomimetics |
| MeSH PA | D014179 | Neurotransmitter Uptake Inhibitors |
| MeSH PA | D015259 | Dopamine Agents |
| MeSH PA | D018377 | Neurotransmitter Agents |
| MeSH PA | D018663 | Adrenergic Agents |
| MeSH PA | D018759 | Adrenergic Uptake Inhibitors |
| MeSH PA | D018765 | Dopamine Uptake Inhibitors |
| MeSH PA | D049990 | Membrane Transport Modulators |
| FDA PE | N0000175729 | Central Nervous System Stimulation |
| FDA EPC | N0000175739 | Central Nervous System Stimulant |
| CHEBI has role | CHEBI:74518 | anti-obesity agent |
| Disease | Relation | SNOMED_ID | DOID |
|---|---|---|---|
| Narcolepsy | indication | 60380001 | DOID:8986 |
| Attention deficit hyperactivity disorder | indication | 406506008 | |
| Obesity | indication | 414916001 | DOID:9970 |
| Ocular hypertension | contraindication | 4210003 | DOID:9282 |
| Gilles de la Tourette's syndrome | contraindication | 5158005 | DOID:11119 |
| Suicidal thoughts | contraindication | 6471006 | |
| Dependent drug abuse | contraindication | 6525002 | |
| Alcoholism | contraindication | 7200002 | |
| Hyperammonemia | contraindication | 9360008 | |
| Chronic obstructive lung disease | contraindication | 13645005 | DOID:3083 |
| Bipolar disorder | contraindication | 13746004 | DOID:3312 |
| Hepatic encephalopathy | contraindication | 13920009 | DOID:13413 |
| Myocardial infarction | contraindication | 22298006 | DOID:5844 |
| Glaucoma | contraindication | 23986001 | DOID:1686 |
| Feeling agitated | contraindication | 24199005 | |
| Hyperthyroidism | contraindication | 34486009 | DOID:7998 |
| Depressive disorder | contraindication | 35489007 | |
| Hypertensive disorder | contraindication | 38341003 | DOID:10763 |
| Hyperactive behavior | contraindication | 44548000 | |
| Conduction disorder of the heart | contraindication | 44808001 | |
| Chronic heart failure | contraindication | 48447003 | |
| Disorder of cardiovascular system | contraindication | 49601007 | DOID:1287 |
| Anorexia nervosa | contraindication | 56882008 | DOID:8689 |
| Hepatic failure | contraindication | 59927004 | |
| Aggressive behavior | contraindication | 61372001 | |
| Substance abuse | contraindication | 66214007 | |
| Psychotic disorder | contraindication | 69322001 | |
| Arteriosclerotic vascular disease | contraindication | 72092001 | |
| Hepatic coma | contraindication | 72836002 | DOID:12550 |
| Diabetes mellitus | contraindication | 73211009 | DOID:9351 |
| Sleep apnea | contraindication | 73430006 | DOID:0050847 |
| Open-angle glaucoma | contraindication | 84494001 | DOID:1067 |
| Cardiomyopathy | contraindication | 85898001 | DOID:0050700 |
| Weight loss | contraindication | 89362005 | |
| Kidney disease | contraindication | 90708001 | DOID:557 |
| Structural disorder of heart | contraindication | 128599005 | |
| Seizure disorder | contraindication | 128613002 | |
| Motor tic disorder | contraindication | 230337001 | |
| Cerebrovascular accident | contraindication | 230690007 | |
| Mania | contraindication | 231494001 | |
| Disease of liver | contraindication | 235856003 | DOID:409 |
| Sleep automatism | contraindication | 247962006 | |
| Anemia | contraindication | 271737000 | DOID:2355 |
| Pregnancy, function | contraindication | 289908002 | |
| Thrombocytopenic disorder | contraindication | 302215000 | DOID:1588 |
| Neutropenic disorder | contraindication | 303011007 | DOID:1227 |
| Angle-closure glaucoma | contraindication | 392291006 | DOID:13550 |
| Cardiovascular event risk | contraindication | 395112001 | |
| Visual impairment | contraindication | 397540003 | |
| Respiratory insufficiency | contraindication | 409623005 | |
| Breastfeeding (mother) | contraindication | 413712001 | |
| Disorder of coronary artery | contraindication | 414024009 | |
| Myocardial ischemia | contraindication | 414795007 | DOID:3393 |
| Myocardial infarction in recovery phase | contraindication | 418044006 | |
| Porphyria | contraindication | 418470004 | |
| Hypertensive urgency | contraindication | 443482000 | |
| Acute exacerbation of asthma | contraindication | 708038006 |
None
None
| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 9.89 | Basic |
| Formulation strength | Trade name | Applicant | Application number | Approval date | Type | Dose form | Route | Patent number | Patent expiration date | Patent use |
|---|---|---|---|---|---|---|---|---|---|---|
| 12.5MG;12.5MG;12.5MG;12.5MG | MYDAYIS | TAKEDA PHARMS USA | N022063 | June 20, 2017 | RX | CAPSULE, EXTENDED RELEASE | ORAL | 9173857 | May 12, 2026 | TREATMENT OF ATTENTION DEFICIT HYPERACTIVITY DISORDER |
| 3.125MG;3.125MG;3.125MG;3.125MG | MYDAYIS | TAKEDA PHARMS USA | N022063 | June 20, 2017 | RX | CAPSULE, EXTENDED RELEASE | ORAL | 9173857 | May 12, 2026 | TREATMENT OF ATTENTION DEFICIT HYPERACTIVITY DISORDER |
| 6.25MG;6.25MG;6.25MG;6.25MG | MYDAYIS | TAKEDA PHARMS USA | N022063 | June 20, 2017 | RX | CAPSULE, EXTENDED RELEASE | ORAL | 9173857 | May 12, 2026 | TREATMENT OF ATTENTION DEFICIT HYPERACTIVITY DISORDER |
| 9.375MG;9.375MG;9.375MG;9.375MG | MYDAYIS | TAKEDA PHARMS USA | N022063 | June 20, 2017 | RX | CAPSULE, EXTENDED RELEASE | ORAL | 9173857 | May 12, 2026 | TREATMENT OF ATTENTION DEFICIT HYPERACTIVITY DISORDER |
| 2MG/ML;EQ 0.5MG BASE/ML | DYANAVEL XR | TRIS PHARMA INC | N208147 | Oct. 19, 2015 | RX | SUSPENSION, EXTENDED RELEASE | ORAL | 11590228 | Sept. 7, 2036 | METHOD OF TREATING ATTENTION DEFICIT HYPERACTIVITY DISORDER |
| 10MG | EVEKEO ODT | AZURITY | N209905 | Jan. 30, 2019 | DISCN | TABLET, ORALLY DISINTEGRATING | ORAL | 11896562 | March 10, 2037 | TREATMENT OF ATTENTION DEFICIT HYPERACTIVITY DISORDER (ADHD) IN PEDIATRIC PATIENTS |
| 15MG | EVEKEO ODT | AZURITY | N209905 | Jan. 30, 2019 | DISCN | TABLET, ORALLY DISINTEGRATING | ORAL | 11896562 | March 10, 2037 | TREATMENT OF ATTENTION DEFICIT HYPERACTIVITY DISORDER (ADHD) IN PEDIATRIC PATIENTS |
| 20MG | EVEKEO ODT | AZURITY | N209905 | Jan. 30, 2019 | DISCN | TABLET, ORALLY DISINTEGRATING | ORAL | 11896562 | March 10, 2037 | TREATMENT OF ATTENTION DEFICIT HYPERACTIVITY DISORDER (ADHD) IN PEDIATRIC PATIENTS |
| 5MG | EVEKEO ODT | AZURITY | N209905 | Jan. 30, 2019 | DISCN | TABLET, ORALLY DISINTEGRATING | ORAL | 11896562 | March 10, 2037 | TREATMENT OF ATTENTION DEFICIT HYPERACTIVITY DISORDER (ADHD) IN PEDIATRIC PATIENTS |
| 12MG;EQ 3MG BASE | DYANAVEL XR 15 | TRIS PHARMA INC | N210526 | Nov. 4, 2021 | RX | TABLET, EXTENDED RELEASE | ORAL | 11590081 | Sept. 24, 2038 | METHOD OF TREATING ATTENTION DEFICIT HYPERACTIVITY DISORDER |
| 16MG;EQ 4MG BASE | DYANAVEL XR 20 | TRIS PHARMA INC | N210526 | Nov. 4, 2021 | RX | TABLET, EXTENDED RELEASE | ORAL | 11590081 | Sept. 24, 2038 | METHOD OF TREATING ATTENTION DEFICIT HYPERACTIVITY DISORDER |
| 4MG;EQ 1MG BASE | DYANAVEL XR 5 | TRIS PHARMA INC | N210526 | Nov. 4, 2021 | RX | TABLET, EXTENDED RELEASE | ORAL | 11590081 | Sept. 24, 2038 | METHOD OF TREATING ATTENTION DEFICIT HYPERACTIVITY DISORDER |
| 8MG;EQ 2MG BASE | DYANAVEL XR 10 | TRIS PHARMA INC | N210526 | Nov. 4, 2021 | RX | TABLET, EXTENDED RELEASE | ORAL | 11590081 | Sept. 24, 2038 | METHOD OF TREATING ATTENTION DEFICIT HYPERACTIVITY DISORDER |
| 12MG;EQ 3MG BASE | DYANAVEL XR 15 | TRIS PHARMA INC | N210526 | Nov. 4, 2021 | RX | TABLET, EXTENDED RELEASE | ORAL | 12458592 | Feb. 11, 2040 | METHOD OF TREATING ATTENTION DEFICIT HYPERACTIVITY DISORDER |
| 16MG;EQ 4MG BASE | DYANAVEL XR 20 | TRIS PHARMA INC | N210526 | Nov. 4, 2021 | RX | TABLET, EXTENDED RELEASE | ORAL | 12458592 | Feb. 11, 2040 | METHOD OF TREATING ATTENTION DEFICIT HYPERACTIVITY DISORDER |
| 4MG;EQ 1MG BASE | DYANAVEL XR 5 | TRIS PHARMA INC | N210526 | Nov. 4, 2021 | RX | TABLET, EXTENDED RELEASE | ORAL | 12458592 | Feb. 11, 2040 | METHOD OF TREATING ATTENTION DEFICIT HYPERACTIVITY DISORDER |
| 8MG;EQ 2MG BASE | DYANAVEL XR 10 | TRIS PHARMA INC | N210526 | Nov. 4, 2021 | RX | TABLET, EXTENDED RELEASE | ORAL | 12458592 | Feb. 11, 2040 | METHOD OF TREATING ATTENTION DEFICIT HYPERACTIVITY DISORDER |
None
| Target | Class | Pharos | UniProt | Action | Type | Activity value (-log[M]) | Mechanism action | Bioact source | MoA source |
|---|---|---|---|---|---|---|---|---|---|
| Sodium-dependent dopamine transporter | Transporter | RELEASING AGENT | Ki | 6.94 | PDSP | CHEMBL | |||
| Sodium-dependent noradrenaline transporter | Transporter | RELEASING AGENT | CHEMBL | CHEMBL | |||||
| Alpha-1A adrenergic receptor | GPCR | WOMBAT-PK | |||||||
| Cocaine- and amphetamine-regulated transcript protein | Transcription factor | WOMBAT-PK | |||||||
| Alpha-2A adrenergic receptor | GPCR | WOMBAT-PK | |||||||
| Trace amine-associated receptor 1 | GPCR | AGONIST | EC50 | 6.22 | SCIENTIFIC LITERATURE | ||||
| Sodium-dependent serotonin transporter | Transporter | Ki | 5.75 | PDSP | |||||
| Sodium-dependent dopamine transporter | Transporter | IC50 | 6.02 | CHEMBL | |||||
| Amine oxidase [flavin-containing] A | Enzyme | Ki | 4.91 | CHEMBL | |||||
| Sodium-dependent noradrenaline transporter | Transporter | IC50 | 6 | CHEMBL | |||||
| 5-hydroxytryptamine receptor 2B | GPCR | Kd | 5.27 | CHEMBL | |||||
| Sodium-dependent serotonin transporter | Transporter | IC50 | 4.35 | CHEMBL | |||||
| Transporter | Transporter | IC50 | 6.70 | CHEMBL | |||||
| Serotonin (5-HT) receptor | GPCR | Kd | 5.27 | CHEMBL | |||||
| Serotonin 1 (5-HT1) receptor | GPCR | Ki | 5.12 | CHEMBL | |||||
| Serotonin 2 (5-HT2) receptor | GPCR | Ki | 4.37 | CHEMBL |
| ID | Source |
|---|---|
| 4019611 | VUID |
| N0000147705 | NUI |
| D02074 | KEGG_DRUG |
| 60-13-9 | SECONDARY_CAS_RN |
| 221057 | RXNORM |
| C0002658 | UMLSCUI |
| CHEBI:2679 | CHEBI |
| CHEMBL405 | ChEMBL_ID |
| CHEMBL501 | ChEMBL_ID |
| CHEMBL1200377 | ChEMBL_ID |
| CHEMBL1200387 | ChEMBL_ID |
| DB00182 | DRUGBANK_ID |
| C090411 | MESH_SUPPLEMENTAL_RECORD_UI |
| 64770-51-0 | SECONDARY_CAS_RN |
| 3007 | PUBCHEM_CID |
| 290726 | MMSL |
| 31375 | MMSL |
| 4188 | MMSL |
| 4189 | MMSL |
| 6025 | MMSL |
| d00803 | MMSL |
| D000661 | MESH_DESCRIPTOR_UI |
| 377 | INN_ID |
| 4804 | IUPHAR_LIGAND_ID |
| 4018832 | VANDF |
| 4018833 | VANDF |
| 4018834 | VANDF |
| 4019611 | VANDF |
| 4022215 | VANDF |
| CK833KGX7E | UNII |
| 001790 | NDDF |
| 001791 | NDDF |
| 001792 | NDDF |
| 006719 | NDDF |
| 116344009 | SNOMEDCT_US |
| 22672005 | SNOMEDCT_US |
| 232451000087107 | SNOMEDCT_US |
| 703842006 | SNOMEDCT_US |
| 87148003 | SNOMEDCT_US |
| CK833KGX7E | INXIGHT DRUGS |