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| Stem definition | Drug id | CAS RN |
|---|---|---|
| 4672 | 65847-85-0 |
| Molecule | Description |
|---|---|
|
Synonyms:
|
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None
None
| Property | Description | Value | Unit | Confidence | Similarity |
|---|---|---|---|---|---|
| kinase-safety-class | ACVR2B,AXL,BRAF,CAMK2D,CDK5,CDK9,DDR1,EIF2AK3,ERBB2,GRK2,MAPK7,MARK4,NTRK2,PDK2,PDK4,PRKDC,STK33,TTK | 18 | |||
| kinase-selectivity-class | AXL,BRAF,CDK9,DDR1,DYRK1B,EPHB4,FLT3,JAK1,MAP3K21,MAPK7,MARK4,MTOR,PDK4,PRKCD,SIK2,SIK3,STK33,TTK | 18 | |||
| pfas-class | PFAS structural alert (1 = True, 0 = False) | 1 |
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 |
|---|---|---|---|---|---|---|
| Obstructive airways disorder | 484.94 | 37.67 | 183 | 8316 | 24576 | 42588260 |
| Full blood count abnormal | 430.99 | 37.67 | 177 | 8322 | 29699 | 42583137 |
| Wheezing | 356.88 | 37.67 | 187 | 8312 | 54594 | 42558242 |
| Neuritis | 345.20 | 37.67 | 101 | 8398 | 6119 | 42606717 |
| Pulmonary vasculitis | 340.07 | 37.67 | 100 | 8399 | 6166 | 42606670 |
| Asthma | 334.25 | 37.67 | 187 | 8312 | 62127 | 42550709 |
| Loss of personal independence in daily activities | 304.37 | 37.67 | 163 | 8336 | 49653 | 42563183 |
| Neurological symptom | 298.08 | 37.67 | 101 | 8398 | 9890 | 42602946 |
| Therapeutic product effect incomplete | 293.62 | 37.67 | 180 | 8319 | 70759 | 42542077 |
| Respiratory symptom | 291.45 | 37.67 | 102 | 8397 | 11004 | 42601832 |
| Dust allergy | 284.51 | 37.67 | 84 | 8415 | 5248 | 42607588 |
| Eosinophilic granulomatosis with polyangiitis | 284.18 | 37.67 | 94 | 8405 | 8544 | 42604292 |
| Total lung capacity abnormal | 263.56 | 37.67 | 76 | 8423 | 4367 | 42608469 |
| Pulmonary alveolar haemorrhage | 259.24 | 37.67 | 101 | 8398 | 14715 | 42598121 |
| Sleep disorder due to a general medical condition | 246.60 | 37.67 | 102 | 8397 | 17351 | 42595485 |
| Vasculitis | 244.77 | 37.67 | 103 | 8396 | 18291 | 42594545 |
| Forced expiratory volume decreased | 242.85 | 37.67 | 81 | 8418 | 7549 | 42605287 |
| Productive cough | 223.80 | 37.67 | 135 | 8364 | 51432 | 42561404 |
| Mite allergy | 219.78 | 37.67 | 68 | 8431 | 4978 | 42607858 |
| Mycotic allergy | 217.62 | 37.67 | 67 | 8432 | 4824 | 42608012 |
| Spirometry abnormal | 210.09 | 37.67 | 66 | 8433 | 5080 | 42607756 |
| Conjunctivitis allergic | 209.19 | 37.67 | 68 | 8431 | 5843 | 42606993 |
| Antineutrophil cytoplasmic antibody positive | 203.58 | 37.67 | 62 | 8437 | 4303 | 42608533 |
| Pulmonary fibrosis | 202.16 | 37.67 | 101 | 8398 | 26580 | 42586256 |
| Normochromic normocytic anaemia | 180.98 | 37.67 | 68 | 8431 | 8963 | 42603873 |
| Hypothyroidism | 179.08 | 37.67 | 99 | 8400 | 31985 | 42580851 |
| Malignant melanoma in situ | 171.53 | 37.67 | 49 | 8450 | 2718 | 42610118 |
| Congenital hiatus hernia | 170.73 | 37.67 | 59 | 8440 | 6115 | 42606721 |
| Nodule | 169.39 | 37.67 | 71 | 8428 | 12463 | 42600373 |
| Haemoptysis | 165.24 | 37.67 | 107 | 8392 | 46060 | 42566776 |
| Lung disorder | 149.58 | 37.67 | 102 | 8397 | 47821 | 42565015 |
| Benign prostatic hyperplasia | 145.71 | 37.67 | 75 | 8424 | 20977 | 42591859 |
| Arteriosclerosis | 138.86 | 37.67 | 69 | 8430 | 17920 | 42594916 |
| Arteriosclerosis coronary artery | 136.40 | 37.67 | 69 | 8430 | 18608 | 42594228 |
| Micturition urgency | 133.16 | 37.67 | 59 | 8440 | 11839 | 42600997 |
| Breath sounds abnormal | 132.24 | 37.67 | 59 | 8440 | 12034 | 42600802 |
| Hypercholesterolaemia | 128.81 | 37.67 | 59 | 8440 | 12790 | 42600046 |
| Joint injury | 121.33 | 37.67 | 59 | 8440 | 14617 | 42598219 |
| Capillaritis | 118.35 | 37.67 | 35 | 8464 | 2193 | 42610643 |
| Bronchiectasis | 109.89 | 37.67 | 59 | 8440 | 17960 | 42594876 |
| Chronic obstructive pulmonary disease | 107.99 | 37.67 | 94 | 8405 | 63020 | 42549816 |
| Anxiety | 104.08 | 37.67 | 123 | 8376 | 118437 | 42494399 |
| Dyspnoea exertional | 82.35 | 37.67 | 73 | 8426 | 50075 | 42562761 |
| Dyspnoea | 79.75 | 37.67 | 230 | 8269 | 442391 | 42170445 |
| Transient ischaemic attack | 78.18 | 37.67 | 60 | 8439 | 33679 | 42579157 |
| Gastrooesophageal reflux disease | 66.95 | 37.67 | 62 | 8437 | 44961 | 42567875 |
| Allergy to animal | 63.85 | 37.67 | 16 | 8483 | 534 | 42612302 |
| Hypoxia | 62.12 | 37.67 | 73 | 8426 | 69713 | 42543123 |
| Coronary artery disease | 55.97 | 37.67 | 61 | 8438 | 53659 | 42559177 |
| Thrombosis | 53.37 | 37.67 | 67 | 8432 | 68444 | 42544392 |
| Pain in extremity | 48.21 | 37.67 | 98 | 8401 | 150506 | 42462330 |
| Muscular dystrophy | 42.76 | 37.67 | 9 | 8490 | 135 | 42612701 |
| Perineal infection | 37.96 | 37.67 | 11 | 8488 | 641 | 42612195 |
| 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 |
|---|---|---|---|---|---|---|
| Obstructive airways disorder | 496.63 | 39.35 | 169 | 7959 | 45980 | 110535191 |
| Full blood count abnormal | 442.19 | 39.35 | 163 | 7965 | 55889 | 110525282 |
| Pulmonary vasculitis | 439.92 | 39.35 | 101 | 8027 | 6459 | 110574712 |
| Neuritis | 433.06 | 39.35 | 102 | 8026 | 7297 | 110573874 |
| Respiratory symptom | 366.45 | 39.35 | 103 | 8025 | 14842 | 110566329 |
| Eosinophilic granulomatosis with polyangiitis | 361.90 | 39.35 | 95 | 8033 | 10591 | 110570580 |
| Neurological symptom | 357.52 | 39.35 | 102 | 8026 | 15506 | 110565665 |
| Total lung capacity abnormal | 341.96 | 39.35 | 77 | 8051 | 4506 | 110576665 |
| Pulmonary alveolar haemorrhage | 331.80 | 39.35 | 102 | 8026 | 20048 | 110561123 |
| Vasculitis | 292.57 | 39.35 | 107 | 8021 | 35766 | 110545405 |
| Forced expiratory volume decreased | 283.36 | 39.35 | 82 | 8046 | 13094 | 110568077 |
| Mite allergy | 282.67 | 39.35 | 69 | 8059 | 5734 | 110575437 |
| Dust allergy | 280.37 | 39.35 | 69 | 8059 | 5932 | 110575239 |
| Spirometry abnormal | 276.12 | 39.35 | 67 | 8061 | 5430 | 110575741 |
| Mycotic allergy | 275.84 | 39.35 | 68 | 8060 | 5886 | 110575285 |
| Conjunctivitis allergic | 270.49 | 39.35 | 69 | 8059 | 6862 | 110574309 |
| Antineutrophil cytoplasmic antibody positive | 260.75 | 39.35 | 63 | 8065 | 5013 | 110576158 |
| Productive cough | 254.88 | 39.35 | 137 | 7991 | 114168 | 110467003 |
| Loss of personal independence in daily activities | 251.16 | 39.35 | 149 | 7979 | 149871 | 110431300 |
| Therapeutic product effect incomplete | 237.92 | 39.35 | 167 | 7961 | 223638 | 110357533 |
| Asthma | 234.60 | 39.35 | 173 | 7955 | 250118 | 110331053 |
| Congenital hiatus hernia | 232.93 | 39.35 | 60 | 8068 | 6199 | 110574972 |
| Wheezing | 229.34 | 39.35 | 172 | 7956 | 255058 | 110326113 |
| Haemoptysis | 227.64 | 39.35 | 109 | 8019 | 71245 | 110509926 |
| Normochromic normocytic anaemia | 227.24 | 39.35 | 69 | 8059 | 12988 | 110568183 |
| Benign prostatic hyperplasia | 224.50 | 39.35 | 74 | 8054 | 18160 | 110563011 |
| Malignant melanoma in situ | 208.05 | 39.35 | 49 | 8079 | 3493 | 110577678 |
| Hypothyroidism | 198.57 | 39.35 | 100 | 8028 | 72799 | 110508372 |
| Sleep disorder due to a general medical condition | 188.96 | 39.35 | 87 | 8041 | 52025 | 110529146 |
| Arteriosclerosis | 187.57 | 39.35 | 70 | 8058 | 24697 | 110556474 |
| Arteriosclerosis coronary artery | 186.61 | 39.35 | 70 | 8058 | 25048 | 110556123 |
| Nodule | 175.64 | 39.35 | 72 | 8056 | 32559 | 110548612 |
| Pulmonary fibrosis | 174.91 | 39.35 | 103 | 8025 | 101939 | 110479232 |
| Micturition urgency | 166.25 | 39.35 | 60 | 8068 | 19260 | 110561911 |
| Breath sounds abnormal | 150.27 | 39.35 | 60 | 8068 | 25344 | 110555827 |
| Capillaritis | 149.85 | 39.35 | 35 | 8093 | 2404 | 110578767 |
| Bronchiectasis | 129.35 | 39.35 | 60 | 8068 | 36433 | 110544738 |
| Joint injury | 124.11 | 39.35 | 60 | 8068 | 39934 | 110541237 |
| Lung disorder | 122.09 | 39.35 | 103 | 8025 | 179944 | 110401227 |
| Chronic obstructive pulmonary disease | 103.19 | 39.35 | 76 | 8052 | 109082 | 110472089 |
| Transient ischaemic attack | 100.23 | 39.35 | 61 | 8067 | 63921 | 110517250 |
| Dyspnoea exertional | 97.34 | 39.35 | 72 | 8056 | 103988 | 110477183 |
| Anxiety | 95.57 | 39.35 | 122 | 8006 | 344956 | 110236215 |
| Coronary artery disease | 93.85 | 39.35 | 61 | 8067 | 71629 | 110509542 |
| Hypoxia | 89.60 | 39.35 | 75 | 8053 | 129440 | 110451731 |
| Thrombosis | 88.01 | 39.35 | 69 | 8059 | 108593 | 110472578 |
| Hypercholesterolaemia | 78.60 | 39.35 | 60 | 8068 | 90777 | 110490394 |
| Dyspnoea | 77.41 | 39.35 | 216 | 7912 | 1106656 | 109474515 |
| Pulmonary embolism | 56.41 | 39.35 | 74 | 8054 | 214400 | 110366771 |
| Gastrooesophageal reflux disease | 50.29 | 39.35 | 64 | 8064 | 179912 | 110401259 |
| Scrotal infection | 46.89 | 39.35 | 11 | 8117 | 769 | 110580402 |
| Muscular dystrophy | 46.84 | 39.35 | 9 | 8119 | 239 | 110580932 |
| Optic nerve operation | 46.23 | 39.35 | 10 | 8118 | 484 | 110580687 |
| Perineal infection | 45.73 | 39.35 | 11 | 8117 | 856 | 110580315 |
| Infected dermal cyst | 40.91 | 39.35 | 11 | 8117 | 1337 | 110579834 |
| Pain in extremity | 39.82 | 39.35 | 101 | 8027 | 487017 | 110094154 |
| Tooth injury | 39.61 | 39.35 | 12 | 8116 | 2234 | 110578937 |
None
| Source | Code | Description |
|---|---|---|
| ATC | M01AX22 | MUSCULO-SKELETAL SYSTEM ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS Other antiinflammatory and antirheumatic agents, non-steroids |
None
None
None
| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 7.19 | Basic |
| pKa2 | 3.73 | Basic |
None
None
None
| ID | Source |
|---|---|
| D05078 | KEGG_DRUG |
| CHEBI:136018 | CHEBI |
| CHEMBL2105059 | ChEMBL_ID |
| C027859 | MESH_SUPPLEMENTAL_RECORD_UI |
| 4587 | INN_ID |
| DB09285 | DRUGBANK_ID |
| R133MWH7X1 | UNII |
| 30225 | RXNORM |
| 005306 | NDDF |
| 773471007 | SNOMEDCT_US |
| C0066803 | UMLSCUI |
| 72106 | PUBCHEM_CID |
None