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| Stem definition | Drug id | CAS RN |
|---|---|---|
| 1794 | 31828-71-4 |
| Dose | Unit | Route |
|---|---|---|
| 0.80 | g | O |
| 0.80 | g | P |
| Property | Value | Reference |
|---|---|---|
| BDDCS (Biopharmaceutical Drug Disposition Classification System) | 1 | Benet LZ, Broccatelli F, Oprea TI |
| EoM (Fraction excreted unchanged in urine) | 9.50 % | Benet LZ, Broccatelli F, Oprea TI |
| MRTD (Maximum Recommended Therapeutic Daily Dose) | 95.63 ยตM/kg/day | Contrera JF, Matthews EJ, Kruhlak NL, Benz RD |
| BA (Bioavailability) | 87 % | Kim MT, Sedykh A, Chakravarti SK, Saiakhov RD, Zhu H |
| Vd (Volume of distribution) | 5.90 L/kg | Lombardo F, Berellini G, Obach RS |
| CL (Clearance) | 8.30 mL/min/kg | Lombardo F, Berellini G, Obach RS |
| fu (Fraction unbound in plasma) | 0.36 % | Lombardo F, Berellini G, Obach RS |
| t_half (Half-life) | 9.90 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,CDK4,CDK5,CDK9,DDR1,DYRK1B,EIF2AK3,EPHB4,ERBB2,FLT3,GRK2,IKBKB,ITK,JAK2,JAK3,MAP2K6,MAP3K21,MAP3K7,MAPK10,MAPK7,MAPKAPK2,MET,NTRK2,PDK2,PDK4,PDPK1,PIK3CB,PIM2,PRKCD,PRKDC,SIK2,SIK3,STK33,SYK,TEK,TGFBR1,ZAP70 | 46 | |||
| kinase-selectivity-class | AXL,BRAF,CSF1R,DDR1,EPHB4,ERBB2,GRK2,LYN,MAPK7,PDK4,PRKCD,SIK2,SIK3,STK33 | 14 | |||
| mdck-mdr1-bcrp-efflux | MDCK-MDR1-BCRP efflux ratio | 0.472 | High | 1 | |
| pfas-class | PFAS structural alert (1 = True, 0 = False) | 0 | |||
| rat-kpuu-brain | Rat brain Kpuu | 0.387 | % | High | 1 |
| Date | Agency | Company | Orphan |
|---|---|---|---|
| Dec. 30, 1985 | FDA | ||
| Dec. 18, 2018 | EMA | Lupin Europe GmbH |
| 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 |
|---|---|---|---|---|---|---|
| Body tinea | 258.98 | 37.83 | 45 | 2192 | 2103 | 90624107 |
| Inhibitory drug interaction | 235.22 | 37.83 | 44 | 2193 | 3119 | 90623091 |
| Infection susceptibility increased | 231.88 | 37.83 | 45 | 2192 | 3881 | 90622329 |
| Poor quality sleep | 212.17 | 37.83 | 59 | 2178 | 24634 | 90601576 |
| Glucose tolerance impaired | 200.03 | 37.83 | 45 | 2192 | 7940 | 90618270 |
| Impaired quality of life | 183.75 | 37.83 | 52 | 2185 | 23092 | 90603118 |
| Impaired work ability | 183.64 | 37.83 | 50 | 2187 | 19276 | 90606934 |
| Purpura | 172.50 | 37.83 | 45 | 2192 | 14733 | 90611477 |
| Bone density decreased | 165.35 | 37.83 | 45 | 2192 | 17300 | 90608910 |
| Hyperlipidaemia | 152.95 | 37.83 | 45 | 2192 | 22871 | 90603339 |
| Oral herpes | 136.09 | 37.83 | 45 | 2192 | 33479 | 90592731 |
| Skin disorder | 132.09 | 37.83 | 45 | 2192 | 36661 | 90589549 |
| Cataract | 112.42 | 37.83 | 48 | 2189 | 72044 | 90554166 |
| Cellulitis | 101.52 | 37.83 | 48 | 2189 | 91289 | 90534921 |
| Herpes zoster | 99.90 | 37.83 | 48 | 2189 | 94596 | 90531614 |
| Weight increased | 97.37 | 37.83 | 81 | 2156 | 417846 | 90208364 |
| Immune thrombocytopenia | 96.94 | 37.83 | 28 | 2209 | 13298 | 90612912 |
| Drug ineffective | 84.17 | 37.83 | 133 | 2104 | 1384165 | 89242045 |
| Therapy non-responder | 60.11 | 37.83 | 39 | 2198 | 136665 | 90489545 |
| Contusion | 56.83 | 37.83 | 48 | 2189 | 251168 | 90375042 |
| Ventricular tachycardia | 50.50 | 37.83 | 20 | 2217 | 24688 | 90601522 |
| Insomnia | 47.02 | 37.83 | 49 | 2188 | 333425 | 90292785 |
| Electrocardiogram QT prolonged | 40.22 | 37.83 | 24 | 2213 | 72432 | 90553778 |
| 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 ineffective | 125.60 | 22.67 | 162 | 2190 | 630035 | 41988948 |
| Ventricular tachycardia | 95.60 | 22.67 | 42 | 2310 | 30118 | 42588865 |
| Tracheitis | 57.60 | 22.67 | 13 | 2339 | 1026 | 42617957 |
| Muscular dystrophy | 54.32 | 22.67 | 9 | 2343 | 135 | 42618848 |
| Hyperthyroidism | 52.04 | 22.67 | 22 | 2330 | 14319 | 42604664 |
| Hypertonia | 33.57 | 22.67 | 12 | 2340 | 4989 | 42613994 |
| Treatment failure | 32.08 | 22.67 | 27 | 2325 | 62597 | 42556386 |
| Cardiac failure acute | 30.69 | 22.67 | 15 | 2337 | 13618 | 42605365 |
| Cytomegalovirus infection reactivation | 30.37 | 22.67 | 14 | 2338 | 11164 | 42607819 |
| Neurogenic bladder | 29.65 | 22.67 | 9 | 2343 | 2251 | 42616732 |
| Clonus | 25.73 | 22.67 | 9 | 2343 | 3511 | 42615472 |
| 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 |
|---|---|---|---|---|---|---|
| Body tinea | 233.53 | 26.42 | 44 | 4179 | 2071 | 110583005 |
| Infection susceptibility increased | 201.40 | 26.42 | 44 | 4179 | 4354 | 110580722 |
| Drug ineffective | 199.04 | 26.42 | 264 | 3959 | 1520276 | 109064800 |
| Inhibitory drug interaction | 190.80 | 26.42 | 43 | 4180 | 4904 | 110580172 |
| Poor quality sleep | 170.93 | 26.42 | 57 | 4166 | 28020 | 110557056 |
| Glucose tolerance impaired | 166.19 | 26.42 | 44 | 4179 | 9793 | 110575283 |
| Bone density decreased | 144.90 | 26.42 | 44 | 4179 | 15998 | 110569078 |
| Impaired quality of life | 140.21 | 26.42 | 50 | 4173 | 29967 | 110555109 |
| Impaired work ability | 138.67 | 26.42 | 48 | 4175 | 26371 | 110558705 |
| Purpura | 126.79 | 26.42 | 44 | 4179 | 24344 | 110560732 |
| Ventricular tachycardia | 125.36 | 26.42 | 53 | 4170 | 49956 | 110535120 |
| Hyperlipidaemia | 110.27 | 26.42 | 44 | 4179 | 35804 | 110549272 |
| Oral herpes | 110.00 | 26.42 | 44 | 4179 | 36036 | 110549040 |
| Skin disorder | 102.63 | 26.42 | 44 | 4179 | 42869 | 110542207 |
| Cataract | 90.58 | 26.42 | 49 | 4174 | 79436 | 110505640 |
| Herpes zoster | 76.48 | 26.42 | 49 | 4174 | 108330 | 110476746 |
| Immune thrombocytopenia | 70.51 | 26.42 | 28 | 4195 | 22466 | 110562610 |
| Weight increased | 70.07 | 26.42 | 83 | 4140 | 419561 | 110165515 |
| Cellulitis | 69.76 | 26.42 | 49 | 4174 | 125967 | 110459109 |
| Therapy non-responder | 60.07 | 26.42 | 49 | 4174 | 157258 | 110427818 |
| Tracheitis | 55.82 | 26.42 | 13 | 4210 | 1708 | 110583368 |
| Muscular dystrophy | 52.73 | 26.42 | 9 | 4214 | 239 | 110584837 |
| Contusion | 48.86 | 26.42 | 52 | 4171 | 233309 | 110351767 |
| Hyperthyroidism | 44.73 | 26.42 | 22 | 4201 | 29239 | 110555837 |
| Electrocardiogram QT prolonged | 41.69 | 26.42 | 34 | 4189 | 108926 | 110476150 |
| Drug ineffective for unapproved indication | 39.15 | 26.42 | 32 | 4191 | 102806 | 110482270 |
| Insomnia | 32.39 | 26.42 | 53 | 4170 | 360537 | 110224539 |
| Myotonia | 32.04 | 26.42 | 6 | 4217 | 272 | 110584804 |
| Hypertonia | 31.79 | 26.42 | 12 | 4211 | 8394 | 110576682 |
| Cytomegalovirus infection reactivation | 31.69 | 26.42 | 15 | 4208 | 18318 | 110566758 |
| Cardiac failure acute | 27.82 | 26.42 | 15 | 4208 | 24063 | 110561013 |
None
| Source | Code | Description |
|---|---|---|
| ATC | C01BB02 | CARDIOVASCULAR SYSTEM CARDIAC THERAPY ANTIARRHYTHMICS, CLASS I AND III Antiarrhythmics, class Ib |
| FDA EPC | N0000175426 | Antiarrhythmic |
| MeSH PA | D000889 | Anti-Arrhythmia Agents |
| MeSH PA | D002317 | Cardiovascular Agents |
| MeSH PA | D026941 | Sodium Channel Blockers |
| MeSH PA | D049990 | Membrane Transport Modulators |
| MeSH PA | D061567 | Voltage-Gated Sodium Channel Blockers |
| CHEBI has role | CHEBI:35480 | analgesic |
| CHEBI has role | CHEBI:35554 | cardiovascular drug |
| CHEBI has role | CHEBI:38070 | anti-arrhythmia drug |
| CHEBI has role | CHEBI:53784 | antispasmodic drug |
| Disease | Relation | SNOMED_ID | DOID |
|---|---|---|---|
| Ventricular arrhythmia | indication | 44103008 | |
| Myotonic disorder | indication | 193237003 | DOID:450 |
| Myocardial infarction | contraindication | 22298006 | DOID:5844 |
| Complete atrioventricular block | contraindication | 27885002 | |
| Sick sinus syndrome | contraindication | 36083008 | DOID:13884 |
| Low blood pressure | contraindication | 45007003 | |
| Chronic heart failure | contraindication | 48447003 | |
| Epilepsy | contraindication | 84757009 | DOID:1826 |
| Cardiogenic shock | contraindication | 89138009 | |
| Liver function tests abnormal | contraindication | 166603001 | |
| Second degree atrioventricular block | contraindication | 195042002 | |
| Disease of liver | contraindication | 235856003 | DOID:409 |
| Smokes tobacco daily | contraindication | 449868002 |
None
None
| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 9.01 | Basic |
None
None
| Target | Class | Pharos | UniProt | Action | Type | Activity value (-log[M]) | Mechanism action | Bioact source | MoA source |
|---|---|---|---|---|---|---|---|---|---|
| Sodium channel protein type 2 subunit alpha | Ion channel | BLOCKER | IC50 | 5.54 | CHEMBL | CHEMBL | |||
| Sodium channel protein type 4 subunit alpha | Ion channel | BLOCKER | IC50 | 4.38 | WOMBAT-PK | CHEMBL | |||
| Sodium channel protein type 9 subunit alpha | Ion channel | BLOCKER | Ki | 4.89 | CHEMBL | CHEMBL | |||
| Sodium channel protein type 10 subunit alpha | Ion channel | BLOCKER | IC50 | 4.25 | CHEMBL | CHEMBL | |||
| Sodium channel protein type 5 subunit alpha | Ion channel | BLOCKER | IC50 | 4.53 | WOMBAT-PK | CHEMBL | |||
| Sodium channel subunit beta-4 | Ion channel | WOMBAT-PK | |||||||
| Potassium voltage-gated channel subfamily H member 2 | Ion channel | IC50 | 5 | CHEMBL | |||||
| 5-hydroxytryptamine receptor 2B | GPCR | Ki | 6.14 | DRUG MATRIX | |||||
| Sodium channel protein type 1 subunit alpha | Ion channel | IC50 | 4.96 | CHEMBL | |||||
| Potassium channel subfamily K member 3 | Ion channel | IC50 | 4.01 | CHEMBL | |||||
| Potassium/sodium hyperpolarization-activated cyclic nucleotide-gated channel 4 | Ion channel | IC50 | 3.51 | WOMBAT-PK | |||||
| Solute carrier family 22 member 2 | Transporter | IC50 | 4.26 | WOMBAT-PK | |||||
| Potassium channel subfamily K member 2 | Ion channel | IC50 | 5.39 | CHEMBL | |||||
| Glucosylceramidase | Enzyme | Kd | 4.43 | CHEMBL | |||||
| Sodium channel subunit beta-1 | Ion channel | WOMBAT-PK | |||||||
| Sodium channel subunit beta-2 | Ion channel | WOMBAT-PK | |||||||
| Sodium channel subunit beta-3 | Ion channel | WOMBAT-PK | |||||||
| Sodium channel protein type X alpha subunit | Ion channel | IC50 | 4.51 | CHEMBL | |||||
| Sodium channel protein type 9 subunit alpha | Ion channel | IC50 | 4.96 | CHEMBL | |||||
| Sodium channel protein type 1 subunit alpha | Ion channel | IC50 | 4.68 | CHEMBL |
| ID | Source |
|---|---|
| 4019837 | VUID |
| N0000147925 | NUI |
| D00639 | KEGG_DRUG |
| 5370-01-4 | SECONDARY_CAS_RN |
| 4019066 | VANDF |
| 4019837 | VANDF |
| C0025887 | UMLSCUI |
| CHEBI:6916 | CHEBI |
| CHEMBL558 | ChEMBL_ID |
| DB00379 | DRUGBANK_ID |
| CHEMBL1200606 | ChEMBL_ID |
| D008801 | MESH_DESCRIPTOR_UI |
| 4178 | PUBCHEM_CID |
| 3262 | INN_ID |
| 2629 | IUPHAR_LIGAND_ID |
| 1U511HHV4Z | UNII |
| 142138 | RXNORM |
| 1108 | MMSL |
| 5109 | MMSL |
| d00300 | MMSL |
| 000630 | NDDF |
| 004485 | NDDF |
| 108500007 | SNOMEDCT_US |
| 372909002 | SNOMEDCT_US |
| 96298001 | SNOMEDCT_US |
| Product | Category | Ingredients | NDC | Form | Quantity | Route | Marketing | Label |
|---|---|---|---|---|---|---|---|---|
| Mexiletine Hydrochloride | HUMAN PRESCRIPTION DRUG LABEL | 1 | 0093-8739 | CAPSULE | 150 mg | ORAL | ANDA | 20 sections |
| Mexiletine Hydrochloride | HUMAN PRESCRIPTION DRUG LABEL | 1 | 0093-8740 | CAPSULE | 200 mg | ORAL | ANDA | 20 sections |
| Mexiletine Hydrochloride | HUMAN PRESCRIPTION DRUG LABEL | 1 | 0093-8741 | CAPSULE | 250 mg | ORAL | ANDA | 20 sections |
| Mexiletine Hydrochloride | HUMAN PRESCRIPTION DRUG LABEL | 1 | 10135-730 | CAPSULE | 150 mg | ORAL | ANDA | 22 sections |
| Mexiletine Hydrochloride | HUMAN PRESCRIPTION DRUG LABEL | 1 | 10135-731 | CAPSULE | 200 mg | ORAL | ANDA | 22 sections |
| Mexiletine Hydrochloride | HUMAN PRESCRIPTION DRUG LABEL | 1 | 10135-732 | CAPSULE | 250 mg | ORAL | ANDA | 22 sections |
| Mexiletine hydrochloride | HUMAN PRESCRIPTION DRUG LABEL | 1 | 31722-036 | CAPSULE | 150 mg | ORAL | ANDA | 17 sections |
| Mexiletine hydrochloride | HUMAN PRESCRIPTION DRUG LABEL | 1 | 31722-037 | CAPSULE | 200 mg | ORAL | ANDA | 17 sections |
| Mexiletine hydrochloride | HUMAN PRESCRIPTION DRUG LABEL | 1 | 31722-038 | CAPSULE | 250 mg | ORAL | ANDA | 17 sections |
| Mexiletine Hydrochloride | Human Prescription Drug Label | 1 | 33342-555 | CAPSULE | 150 mg | ORAL | ANDA | 17 sections |
| Mexiletine Hydrochloride | Human Prescription Drug Label | 1 | 33342-556 | CAPSULE | 200 mg | ORAL | ANDA | 17 sections |
| Mexiletine Hydrochloride | Human Prescription Drug Label | 1 | 33342-557 | CAPSULE | 250 mg | ORAL | ANDA | 17 sections |
| Mexiletine Hydrochloride | HUMAN PRESCRIPTION DRUG LABEL | 1 | 42291-624 | CAPSULE | 150 mg | ORAL | ANDA | 19 sections |
| Mexiletine Hydrochloride | HUMAN PRESCRIPTION DRUG LABEL | 1 | 42291-625 | CAPSULE | 200 mg | ORAL | ANDA | 19 sections |
| Mexiletine Hydrochloride | HUMAN PRESCRIPTION DRUG LABEL | 1 | 42291-626 | CAPSULE | 250 mg | ORAL | ANDA | 19 sections |
| MEXILETINE HYDROCHLORIDE | HUMAN PRESCRIPTION DRUG LABEL | 1 | 50742-239 | CAPSULE | 150 mg | ORAL | ANDA | 17 sections |
| MEXILETINE HYDROCHLORIDE | HUMAN PRESCRIPTION DRUG LABEL | 1 | 50742-240 | CAPSULE | 200 mg | ORAL | ANDA | 17 sections |
| MEXILETINE HYDROCHLORIDE | HUMAN PRESCRIPTION DRUG LABEL | 1 | 50742-241 | CAPSULE | 250 mg | ORAL | ANDA | 17 sections |
| Mexiletine Hydrochloride | HUMAN PRESCRIPTION DRUG LABEL | 1 | 51407-379 | CAPSULE | 150 mg | ORAL | ANDA | 20 sections |
| Mexiletine Hydrochloride | HUMAN PRESCRIPTION DRUG LABEL | 1 | 51407-380 | CAPSULE | 200 mg | ORAL | ANDA | 20 sections |
| Mexiletine Hydrochloride | HUMAN PRESCRIPTION DRUG LABEL | 1 | 51407-381 | CAPSULE | 250 mg | ORAL | ANDA | 20 sections |
| Mexiletine hydrochloride | HUMAN PRESCRIPTION DRUG LABEL | 1 | 60687-778 | CAPSULE | 150 mg | ORAL | ANDA | 21 sections |
| MEXILETINE HYDROCHLORIDE | HUMAN PRESCRIPTION DRUG LABEL | 1 | 62135-785 | CAPSULE | 250 mg | ORAL | ANDA | 12 sections |
| Mexiletine Hydrochloride | HUMAN PRESCRIPTION DRUG LABEL | 1 | 62559-820 | CAPSULE | 150 mg | ORAL | ANDA | 20 sections |
| Mexiletine Hydrochloride | HUMAN PRESCRIPTION DRUG LABEL | 1 | 62559-820 | CAPSULE | 150 mg | ORAL | ANDA | 20 sections |
| Mexiletine Hydrochloride | HUMAN PRESCRIPTION DRUG LABEL | 1 | 62559-821 | CAPSULE | 200 mg | ORAL | ANDA | 20 sections |
| Mexiletine Hydrochloride | HUMAN PRESCRIPTION DRUG LABEL | 1 | 62559-821 | CAPSULE | 200 mg | ORAL | ANDA | 20 sections |
| Mexiletine Hydrochloride | HUMAN PRESCRIPTION DRUG LABEL | 1 | 62559-822 | CAPSULE | 250 mg | ORAL | ANDA | 20 sections |
| Mexiletine Hydrochloride | HUMAN PRESCRIPTION DRUG LABEL | 1 | 62559-822 | CAPSULE | 250 mg | ORAL | ANDA | 20 sections |
| MEXILETINE HYDROCHLORIDE | Human Prescription Drug Label | 1 | 62756-955 | CAPSULE | 150 mg | ORAL | ANDA | 11 sections |