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| Stem definition | Drug id | CAS RN |
|---|---|---|
| 692 | 2030-63-9 |
| Dose | Unit | Route |
|---|---|---|
| 0.10 | g | O |
| Property | Value | Reference |
|---|---|---|
| BDDCS (Biopharmaceutical Drug Disposition Classification System) | 2 | Benet LZ, Broccatelli F, Oprea TI |
| S (Water solubility) | 0.00 mg/mL | Bocci G, Oprea TI, Benet LZ |
| EoM (Fraction excreted unchanged in urine) | 0.20 % | Benet LZ, Broccatelli F, Oprea TI |
| MRTD (Maximum Recommended Therapeutic Daily Dose) | 7.03 ยตM/kg/day | Contrera JF, Matthews EJ, Kruhlak NL, Benz RD |
| BA (Bioavailability) | 57 % | Kim MT, Sedykh A, Chakravarti SK, Saiakhov RD, Zhu H |
| Property | Description | Value | Unit | Confidence | Similarity |
|---|---|---|---|---|---|
| azlogd74 | LogD at pH 7.4 | 4.763 | High | 1 | |
| caco2-efflux | Caco-2 efflux ratio (BA/AB) | 4.932 | High | 1 | |
| caco2-intrinsic-papp | Caco-2 intrinsic apparent permeability | 0.033 | 10^-6 cm/s | High | 1 |
| dh-clint | Dog hepatocyte intrinsic clearance | 5.093 | uL/min/10^6 cells | High | 1 |
| dppb | Dog plasma protein binding (% unbound) | 0.220 | % | High | 1 |
| fcs-ppb | Fetal calf serum protein binding (% unbound) | 0.320 | % | High | 1 |
| herg | hERG pIC50 | 5.455 | pIC50 | High | 1 |
| hh-clint | Human hepatocyte intrinsic clearance | 1.581 | uL/min/10^6 cells | High | 1 |
| hlm-clint | Human liver microsomal intrinsic clearance | 4.710 | uL/min/mg protein | High | 1 |
| hppb | Human plasma protein binding (% unbound) | 0.520 | % | High | 1 |
| kinase-safety-class | ACVR2A,ACVR2B,ACVRL1,AKT1,AKT2,AKT3,ALK,AURKA,AXL,BRAF,BTK,CAMK2B,CAMK2D,CDK1,CDK5,CDK9,CHEK1,CSF1R,DDR1,DYRK1B,EIF2AK3,EPHB4,ERBB2,FLT3,GRK2,GSK3B,ITK,JAK1,JAK2,JAK3,MAP2K6,MAP3K1,MAP3K11,MAP3K21,MAP3K7,MAP4K1,MAP4K3,MAPK10,MAPK7,MAPK9,MAPKAPK2,MARK4,MELK,MET,MTOR,NTRK2,PDK4,PDPK1,PIK3CA,PIK3CB,PIK3CD,PIK3CG,PIM2,PRKCD,PRKDC,SGK1,SIK2,SIK3,STK33,SYK,TEK,TGFBR1,TTK,ULK1,ZAP70 | 65 | |||
| kinase-selectivity-class | ACVR2B,BRAF,ERBB2,SIK2,SIK3,ZAP70 | 6 | |||
| mdck-mdr1-efflux | MDCK-MDR1 efflux ratio | 2.489 | High | 1 | |
| mh-clint | Mouse hepatocyte intrinsic clearance | 14.521 | High | 1 | |
| mppb | Mouse plasma protein binding (% unbound) | 0.170 | High | 1 | |
| nih-mdck-mdr1-efflux | NIH MDCK-MDR1 efflux ratio | 1.503 | High | 1 | |
| pfas-class | PFAS structural alert (1 = True, 0 = False) | 0 | |||
| pppb | Pig plasma protein binding (% unbound) | 0.200 | % | High | 1 |
| rh-clint | Rat hepatocyte intrinsic clearance | 5.420 | uL/min/10^6 cells | High | 1 |
| rh-fuinc | Rat hepatocyte fraction unbound in incubation | 0.120 | % | High | 1 |
| rppb | Rat plasma protein binding (% unbound) | 0.230 | % | High | 1 |
| solubility-dd | Solubility at pH 7.4 in DMSO | 0.393 | uM | High | 1 |
| Date | Agency | Company | Orphan |
|---|---|---|---|
| Dec. 15, 1986 | FDA | NOVARTIS |
| 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 |
|---|---|---|---|---|---|---|
| Electrocardiogram QT prolonged | 702.20 | 24.64 | 254 | 7411 | 72202 | 90548580 |
| Drug resistance | 310.10 | 24.64 | 111 | 7554 | 30338 | 90590444 |
| Neuropathy peripheral | 168.21 | 24.64 | 118 | 7547 | 136852 | 90483930 |
| Mycobacterium avium complex infection | 145.65 | 24.64 | 39 | 7626 | 4059 | 90616723 |
| Anaemia | 141.35 | 24.64 | 161 | 7504 | 352641 | 90268141 |
| Ototoxicity | 126.11 | 24.64 | 30 | 7635 | 1934 | 90618848 |
| Skin discolouration | 113.13 | 24.64 | 61 | 7604 | 44254 | 90576528 |
| Hepatotoxicity | 97.59 | 24.64 | 56 | 7609 | 45786 | 90574996 |
| Drug reaction with eosinophilia and systemic symptoms | 93.07 | 24.64 | 53 | 7612 | 42705 | 90578077 |
| Off label use | 87.48 | 24.64 | 246 | 7419 | 1102006 | 89518776 |
| Vomiting | 84.23 | 24.64 | 197 | 7468 | 788096 | 89832686 |
| Optic neuropathy | 83.36 | 24.64 | 23 | 7642 | 2675 | 90618107 |
| Haemoptysis | 79.85 | 24.64 | 44 | 7621 | 33276 | 90587506 |
| Polyneuropathy | 73.92 | 24.64 | 35 | 7630 | 19306 | 90601476 |
| Type 2 lepra reaction | 72.30 | 24.64 | 11 | 7654 | 56 | 90620726 |
| Mycobacterium abscessus infection | 72.04 | 24.64 | 17 | 7648 | 1058 | 90619724 |
| Skin hyperpigmentation | 69.73 | 24.64 | 25 | 7640 | 6826 | 90613956 |
| Tinnitus | 69.34 | 24.64 | 44 | 7621 | 43058 | 90577724 |
| Alanine aminotransferase increased | 63.09 | 24.64 | 63 | 7602 | 118275 | 90502507 |
| Aspartate aminotransferase increased | 62.77 | 24.64 | 59 | 7606 | 102878 | 90517904 |
| Cough | 62.76 | 24.64 | 112 | 7553 | 368850 | 90251932 |
| Respiratory failure | 59.40 | 24.64 | 61 | 7604 | 118357 | 90502425 |
| Deafness | 54.67 | 24.64 | 30 | 7635 | 22484 | 90598298 |
| Nausea | 52.18 | 24.64 | 208 | 7457 | 1110108 | 89510674 |
| Deafness neurosensory | 51.46 | 24.64 | 20 | 7645 | 6821 | 90613961 |
| Disseminated mycobacterium avium complex infection | 50.78 | 24.64 | 10 | 7655 | 262 | 90620520 |
| Transaminases increased | 50.14 | 24.64 | 34 | 7631 | 37158 | 90583624 |
| Product use in unapproved indication | 49.54 | 24.64 | 96 | 7569 | 336140 | 90284642 |
| Pathogen resistance | 44.80 | 24.64 | 19 | 7646 | 8096 | 90612686 |
| Myelosuppression | 41.14 | 24.64 | 35 | 7630 | 53556 | 90567226 |
| Antimicrobial susceptibility test intermediate | 39.52 | 24.64 | 6 | 7659 | 30 | 90620752 |
| Mycobacterial infection | 38.14 | 24.64 | 12 | 7653 | 2198 | 90618584 |
| Dyspnoea | 38.05 | 24.64 | 161 | 7504 | 880794 | 89739988 |
| Bronchiectasis | 36.41 | 24.64 | 23 | 7642 | 22307 | 90598475 |
| Pain | 32.98 | 24.64 | 22 | 7643 | 996319 | 89624463 |
| Optic neuritis | 32.40 | 24.64 | 16 | 7649 | 9662 | 90611120 |
| Herbal toxicity | 32.02 | 24.64 | 5 | 7660 | 31 | 90620751 |
| Meningitis tuberculous | 31.81 | 24.64 | 8 | 7657 | 650 | 90620132 |
| Hypoacusis | 31.80 | 24.64 | 23 | 7642 | 27827 | 90592955 |
| Incorrect product administration duration | 29.27 | 24.64 | 19 | 7646 | 19303 | 90601479 |
| Nephropathy toxic | 28.32 | 24.64 | 16 | 7649 | 12672 | 90608110 |
| Pyelonephritis chronic | 28.18 | 24.64 | 6 | 7659 | 233 | 90620549 |
| Cystic fibrosis | 27.80 | 24.64 | 11 | 7654 | 3930 | 90616852 |
| Cardiopulmonary failure | 27.16 | 24.64 | 11 | 7654 | 4177 | 90616605 |
| Concomitant disease aggravated | 27.00 | 24.64 | 15 | 7650 | 11503 | 90609279 |
| Paradoxical drug reaction | 26.93 | 24.64 | 12 | 7653 | 5754 | 90615028 |
| Drug-induced liver injury | 25.96 | 24.64 | 35 | 7630 | 90283 | 90530499 |
| Hypokalaemia | 25.08 | 24.64 | 42 | 7623 | 131074 | 90489708 |
| Immune reconstitution inflammatory syndrome | 24.68 | 24.64 | 12 | 7653 | 7007 | 90613775 |
| Atypical mycobacterial infection | 24.65 | 24.64 | 8 | 7657 | 1618 | 90619164 |
| 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 |
|---|---|---|---|---|---|---|
| Electrocardiogram QT prolonged | 805.16 | 22.52 | 311 | 7699 | 47634 | 42565691 |
| Type 2 lepra reaction | 254.85 | 22.52 | 46 | 7964 | 309 | 42613016 |
| Drug resistance | 203.66 | 22.52 | 108 | 7902 | 34140 | 42579185 |
| Hepatotoxicity | 183.28 | 22.52 | 91 | 7919 | 25076 | 42588249 |
| Neuropathy peripheral | 179.03 | 22.52 | 150 | 7860 | 101703 | 42511622 |
| Off label use | 97.95 | 22.52 | 301 | 7709 | 638034 | 41975291 |
| Anaemia | 93.65 | 22.52 | 179 | 7831 | 280099 | 42333226 |
| Intentional product use issue | 87.07 | 22.52 | 86 | 7924 | 71747 | 42541578 |
| Deafness neurosensory | 75.88 | 22.52 | 28 | 7982 | 3718 | 42609607 |
| Drug-induced liver injury | 74.64 | 22.52 | 60 | 7950 | 38213 | 42575112 |
| Nausea | 71.88 | 22.52 | 199 | 7811 | 396600 | 42216725 |
| Ototoxicity | 68.63 | 22.52 | 23 | 7987 | 2302 | 42611023 |
| Skin hyperpigmentation | 65.81 | 22.52 | 26 | 7984 | 4155 | 42609170 |
| Toxic optic neuropathy | 63.63 | 22.52 | 18 | 7992 | 1022 | 42612303 |
| Optic neuropathy | 63.02 | 22.52 | 22 | 7988 | 2490 | 42610835 |
| Deafness | 60.33 | 22.52 | 35 | 7975 | 13105 | 42600220 |
| Tuberculosis | 54.76 | 22.52 | 30 | 7980 | 10069 | 42603256 |
| Pathogen resistance | 53.90 | 22.52 | 31 | 7979 | 11419 | 42601906 |
| Product use in unapproved indication | 53.21 | 22.52 | 111 | 7899 | 184345 | 42428980 |
| Optic neuritis | 52.32 | 22.52 | 22 | 7988 | 4120 | 42609205 |
| Type 1 lepra reaction | 51.16 | 22.52 | 9 | 8001 | 51 | 42613274 |
| Incorrect product administration duration | 51.01 | 22.52 | 24 | 7986 | 5856 | 42607469 |
| Vomiting | 50.02 | 22.52 | 143 | 7867 | 289580 | 42323745 |
| Psoas abscess | 48.85 | 22.52 | 14 | 7996 | 833 | 42612492 |
| HIV infection | 45.06 | 22.52 | 15 | 7995 | 1470 | 42611855 |
| Urinary tract inflammation | 43.74 | 22.52 | 10 | 8000 | 238 | 42613087 |
| Tinnitus | 41.38 | 22.52 | 38 | 7972 | 28900 | 42584425 |
| Preterm premature rupture of membranes | 41.29 | 22.52 | 8 | 8002 | 82 | 42613243 |
| Polyneuropathy | 40.11 | 22.52 | 31 | 7979 | 18630 | 42594695 |
| Drug reaction with eosinophilia and systemic symptoms | 39.51 | 22.52 | 44 | 7966 | 42031 | 42571294 |
| Mycobacterium avium complex infection | 37.97 | 22.52 | 16 | 7994 | 3011 | 42610314 |
| Acoustic neuroma | 37.11 | 22.52 | 8 | 8002 | 144 | 42613181 |
| Ichthyosis | 36.85 | 22.52 | 8 | 8002 | 149 | 42613176 |
| Hypoacusis | 35.76 | 22.52 | 29 | 7981 | 18673 | 42594652 |
| Hepatitis cholestatic | 34.39 | 22.52 | 22 | 7988 | 9802 | 42603523 |
| Aspartate aminotransferase increased | 34.27 | 22.52 | 56 | 7954 | 77107 | 42536218 |
| Mycobacterium haemophilum infection | 33.06 | 22.52 | 9 | 8001 | 443 | 42612882 |
| Conductive deafness | 31.86 | 22.52 | 9 | 8001 | 508 | 42612817 |
| Myelosuppression | 29.20 | 22.52 | 37 | 7973 | 40424 | 42572901 |
| Hypertriglyceridaemia | 28.97 | 22.52 | 20 | 7990 | 10106 | 42603219 |
| Benign soft tissue neoplasm | 27.24 | 22.52 | 6 | 8004 | 120 | 42613205 |
| Blood sodium decreased | 26.25 | 22.52 | 24 | 7986 | 18138 | 42595187 |
| Deafness unilateral | 25.91 | 22.52 | 11 | 7999 | 2108 | 42611217 |
| Cardiopulmonary failure | 25.63 | 22.52 | 14 | 7996 | 4669 | 42608656 |
| Mycobacterial peritonitis | 25.34 | 22.52 | 6 | 8004 | 167 | 42613158 |
| Autism spectrum disorder | 25.31 | 22.52 | 12 | 7998 | 2976 | 42610349 |
| Vestibular disorder | 24.58 | 22.52 | 9 | 8001 | 1168 | 42612157 |
| Mycobacterium abscessus infection | 24.35 | 22.52 | 8 | 8002 | 752 | 42612573 |
| Hepatitis toxic | 23.88 | 22.52 | 11 | 7999 | 2556 | 42610769 |
| Pulmonary tuberculosis | 23.53 | 22.52 | 14 | 7996 | 5487 | 42607838 |
| Disseminated tuberculosis | 22.88 | 22.52 | 11 | 7999 | 2813 | 42610512 |
| Oral candidiasis | 22.72 | 22.52 | 20 | 7990 | 14385 | 42598940 |
| Haemoptysis | 22.54 | 22.52 | 35 | 7975 | 46132 | 42567193 |
| 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 |
|---|---|---|---|---|---|---|
| Electrocardiogram QT prolonged | 1441.51 | 20.44 | 542 | 14263 | 108418 | 110466076 |
| Neuropathy peripheral | 385.37 | 20.44 | 260 | 14545 | 179017 | 110395477 |
| Drug resistance | 364.81 | 20.44 | 169 | 14636 | 56205 | 110518289 |
| Type 2 lepra reaction | 324.53 | 20.44 | 55 | 14750 | 360 | 110574134 |
| Hepatotoxicity | 267.14 | 20.44 | 142 | 14663 | 63258 | 110511236 |
| Anaemia | 231.67 | 20.44 | 323 | 14482 | 546763 | 110027731 |
| Off label use | 159.98 | 20.44 | 500 | 14305 | 1499685 | 109074809 |
| Ototoxicity | 149.18 | 20.44 | 44 | 14761 | 4087 | 110570407 |
| Optic neuropathy | 143.97 | 20.44 | 44 | 14761 | 4614 | 110569880 |
| Drug reaction with eosinophilia and systemic symptoms | 129.87 | 20.44 | 99 | 14706 | 81996 | 110492498 |
| Skin hyperpigmentation | 128.05 | 20.44 | 47 | 14758 | 8649 | 110565845 |
| Polyneuropathy | 118.89 | 20.44 | 66 | 14739 | 31946 | 110542548 |
| Skin discolouration | 111.96 | 20.44 | 74 | 14731 | 48972 | 110525522 |
| Deafness | 110.08 | 20.44 | 59 | 14746 | 26650 | 110547844 |
| Vomiting | 106.24 | 20.44 | 314 | 14491 | 910361 | 109664133 |
| Drug-induced liver injury | 104.66 | 20.44 | 103 | 14702 | 119964 | 110454530 |
| Deafness neurosensory | 98.78 | 20.44 | 40 | 14765 | 9579 | 110564915 |
| Tinnitus | 97.91 | 20.44 | 74 | 14731 | 60466 | 110514028 |
| Aspartate aminotransferase increased | 95.00 | 20.44 | 112 | 14693 | 159824 | 110414670 |
| Pathogen resistance | 92.94 | 20.44 | 46 | 14759 | 17626 | 110556868 |
| Nausea | 91.45 | 20.44 | 366 | 14439 | 1235324 | 109339170 |
| Intentional product use issue | 87.96 | 20.44 | 135 | 14670 | 247771 | 110326723 |
| Toxic optic neuropathy | 84.20 | 20.44 | 22 | 14783 | 1306 | 110573188 |
| Optic neuritis | 83.33 | 20.44 | 37 | 14768 | 11110 | 110563384 |
| Product use in unapproved indication | 80.69 | 20.44 | 182 | 14623 | 447195 | 110127299 |
| Mycobacterium avium complex infection | 80.05 | 20.44 | 30 | 14775 | 5847 | 110568647 |
| Haemoptysis | 79.10 | 20.44 | 70 | 14735 | 71284 | 110503210 |
| Type 1 lepra reaction | 78.86 | 20.44 | 13 | 14792 | 70 | 110574424 |
| Incorrect product administration duration | 78.12 | 20.44 | 43 | 14762 | 20455 | 110554039 |
| Alanine aminotransferase increased | 76.60 | 20.44 | 108 | 14697 | 183665 | 110390829 |
| Hypoacusis | 70.53 | 20.44 | 49 | 14756 | 35142 | 110539352 |
| Myelosuppression | 66.07 | 20.44 | 72 | 14733 | 94268 | 110480226 |
| Respiratory failure | 58.46 | 20.44 | 104 | 14701 | 215228 | 110359266 |
| Tuberculosis | 53.57 | 20.44 | 32 | 14773 | 17742 | 110556752 |
| Transaminases increased | 52.64 | 20.44 | 53 | 14752 | 63337 | 110511157 |
| HIV infection | 52.00 | 20.44 | 15 | 14790 | 1288 | 110573206 |
| Meningitis tuberculous | 47.84 | 20.44 | 14 | 14791 | 1264 | 110573230 |
| Pain | 47.80 | 20.44 | 35 | 14770 | 954920 | 109619574 |
| Cough | 44.18 | 20.44 | 149 | 14656 | 461492 | 110113002 |
| Immune reconstitution inflammatory syndrome | 43.24 | 20.44 | 27 | 14778 | 16199 | 110558295 |
| Cardiopulmonary failure | 42.82 | 20.44 | 21 | 14784 | 7882 | 110566612 |
| Pulmonary tuberculosis | 42.80 | 20.44 | 22 | 14783 | 9117 | 110565377 |
| Ichthyosis | 42.78 | 20.44 | 9 | 14796 | 205 | 110574289 |
| Decreased appetite | 42.42 | 20.44 | 150 | 14655 | 475696 | 110098798 |
| Urinary tract inflammation | 42.40 | 20.44 | 10 | 14795 | 388 | 110574106 |
| Pneumothorax | 41.87 | 20.44 | 36 | 14769 | 35249 | 110539245 |
| Psoas abscess | 41.40 | 20.44 | 13 | 14792 | 1489 | 110573005 |
| Fall | 40.68 | 20.44 | 15 | 14790 | 603467 | 109971027 |
| Mycobacterium abscessus infection | 39.78 | 20.44 | 13 | 14792 | 1693 | 110572801 |
| Infusion related reaction | 39.60 | 20.44 | 3 | 14802 | 381159 | 110193335 |
| Conductive deafness | 39.52 | 20.44 | 9 | 14796 | 299 | 110574195 |
| Hepatitis toxic | 39.01 | 20.44 | 18 | 14787 | 5903 | 110568591 |
| Drug hypersensitivity | 38.76 | 20.44 | 7 | 14798 | 454083 | 110120411 |
| Hypokalaemia | 37.09 | 20.44 | 78 | 14727 | 182370 | 110392124 |
| Antimicrobial susceptibility test intermediate | 36.77 | 20.44 | 6 | 14799 | 30 | 110574464 |
| Mycobacterium haemophilum infection | 36.53 | 20.44 | 10 | 14795 | 709 | 110573785 |
| Hepatitis cholestatic | 36.46 | 20.44 | 25 | 14780 | 17541 | 110556953 |
| Disseminated mycobacterium avium complex infection | 34.87 | 20.44 | 9 | 14796 | 509 | 110573985 |
| Malnutrition | 34.76 | 20.44 | 29 | 14776 | 27250 | 110547244 |
| Autism spectrum disorder | 34.21 | 20.44 | 12 | 14793 | 1936 | 110572558 |
| Mycobacterial infection | 34.10 | 20.44 | 15 | 14790 | 4402 | 110570092 |
| Acoustic neuroma | 33.93 | 20.44 | 8 | 14797 | 310 | 110574184 |
| Atypical mycobacterial infection | 33.86 | 20.44 | 13 | 14792 | 2705 | 110571789 |
| Nasopharyngitis | 33.82 | 20.44 | 6 | 14799 | 394355 | 110180139 |
| Hypertriglyceridaemia | 33.55 | 20.44 | 23 | 14782 | 16131 | 110558363 |
| Treatment noncompliance | 33.54 | 20.44 | 45 | 14760 | 72945 | 110501549 |
| Concomitant disease aggravated | 33.29 | 20.44 | 23 | 14782 | 16341 | 110558153 |
| Pigmentation disorder | 32.52 | 20.44 | 17 | 14788 | 7294 | 110567200 |
| Psychotic disorder | 32.42 | 20.44 | 37 | 14768 | 50900 | 110523594 |
| Foetal growth restriction | 32.40 | 20.44 | 13 | 14792 | 3037 | 110571457 |
| Swelling | 30.85 | 20.44 | 5 | 14800 | 351036 | 110223458 |
| Rheumatoid arthritis | 29.38 | 20.44 | 3 | 14802 | 299610 | 110274884 |
| Benign soft tissue neoplasm | 28.76 | 20.44 | 6 | 14799 | 131 | 110574363 |
| Hepatitis | 27.69 | 20.44 | 46 | 14759 | 90008 | 110484486 |
| Vestibular disorder | 27.21 | 20.44 | 11 | 14794 | 2621 | 110571873 |
| Joint swelling | 26.63 | 20.44 | 13 | 14792 | 442832 | 110131662 |
| Blood sodium decreased | 26.38 | 20.44 | 29 | 14776 | 38290 | 110536204 |
| Infective pulmonary exacerbation of cystic fibrosis | 25.98 | 20.44 | 19 | 14786 | 14752 | 110559742 |
| Histiocytosis | 25.87 | 20.44 | 5 | 14800 | 73 | 110574421 |
| Mycobacterial peritonitis | 25.34 | 20.44 | 6 | 14799 | 237 | 110574257 |
| Nephropathy toxic | 24.71 | 20.44 | 24 | 14781 | 27454 | 110547040 |
| Immune reconstitution inflammatory syndrome associated tuberculosis | 24.45 | 20.44 | 8 | 14797 | 1046 | 110573448 |
| Pyelonephritis chronic | 24.14 | 20.44 | 6 | 14799 | 291 | 110574203 |
| Bronchiectasis | 24.06 | 20.44 | 27 | 14778 | 36466 | 110538028 |
| Chronic obstructive pulmonary disease | 23.74 | 20.44 | 48 | 14757 | 109110 | 110465384 |
| Facial paralysis | 23.38 | 20.44 | 22 | 14783 | 24192 | 110550302 |
| Herbal toxicity | 23.24 | 20.44 | 4 | 14801 | 29 | 110574465 |
| Weight increased | 22.79 | 20.44 | 14 | 14791 | 419630 | 110154864 |
| Bicytopenia | 22.62 | 20.44 | 13 | 14792 | 6711 | 110567783 |
| Tooth discolouration | 22.43 | 20.44 | 8 | 14797 | 1355 | 110573139 |
| Haemolytic anaemia | 22.13 | 20.44 | 20 | 14785 | 20900 | 110553594 |
| Electrolyte imbalance | 22.06 | 20.44 | 26 | 14779 | 37002 | 110537492 |
| Cor pulmonale | 21.71 | 20.44 | 9 | 14796 | 2285 | 110572209 |
| Preterm premature rupture of membranes | 21.60 | 20.44 | 8 | 14797 | 1507 | 110572987 |
| Dyspnoea | 21.34 | 20.44 | 234 | 14571 | 1106638 | 109467856 |
| Poor feeding infant | 21.10 | 20.44 | 5 | 14800 | 198 | 110574296 |
| Haemoglobin decreased | 20.91 | 20.44 | 77 | 14728 | 248650 | 110325844 |
None
| Source | Code | Description |
|---|---|---|
| ATC | J04BA01 | ANTIINFECTIVES FOR SYSTEMIC USE ANTIMYCOBACTERIALS DRUGS FOR TREATMENT OF LEPRA Drugs for treatment of lepra |
| ATC | J04BA51 | ANTIINFECTIVES FOR SYSTEMIC USE ANTIMYCOBACTERIALS DRUGS FOR TREATMENT OF LEPRA Drugs for treatment of lepra |
| FDA EPC | N0000175483 | Antimycobacterial |
| CHEBI has role | CHEBI:35475 | non-steroidal anti-inflammatory drug |
| CHEBI has role | CHEBI:35816 | leprostatic drug |
| CHEBI has role | CHEBI:37958 | dye |
| MeSH PA | D000890 | Anti-Infective Agents |
| MeSH PA | D000893 | Anti-Inflammatory Agents |
| MeSH PA | D000900 | Anti-Bacterial Agents |
| MeSH PA | D007917 | Leprostatic Agents |
| Disease | Relation | SNOMED_ID | DOID |
|---|---|---|---|
| Pyoderma gangrenosum | indication | 74578003 | DOID:8553 |
| Leprosy | indication | 81004002 | DOID:1024 |
| Erythema nodosum leprosum | indication | 240411003 | |
| Multibacillary leprosy | indication | 416257001 | |
| Dapsone resistant leprosy | indication | 416597004 | |
| Mycobacteriosis | off-label use | 88415009 | |
| Nausea and vomiting | contraindication | 16932000 | |
| Splenic infarction | contraindication | 22996003 | DOID:2533 |
| Disorder of digestive system | contraindication | 53619000 | DOID:77 |
| Diarrhea | contraindication | 62315008 | |
| Gastrointestinal hemorrhage | contraindication | 74474003 | |
| Gastrointestinal obstruction | contraindication | 126765001 | |
| Disease of liver | contraindication | 235856003 | DOID:409 |
| Breastfeeding (mother) | contraindication | 413712001 |
None
None
| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 8.81 | Basic |
| pKa2 | 5.53 | Basic |
| pKa3 | 2.07 | Basic |
None
None
| Target | Class | Pharos | UniProt | Action | Type | Activity value (-log[M]) | Mechanism action | Bioact source | MoA source |
|---|---|---|---|---|---|---|---|---|---|
| ATP-binding cassette sub-family G member 2 | Transporter | IC50 | 5.50 | CHEMBL | |||||
| Uncharacterized oxidoreductase CzcO-like | Enzyme | WOMBAT-PK | |||||||
| Cruzipain | Enzyme | IC50 | 5.22 | CHEMBL | |||||
| Spike glycoprotein | Glycoprotein | Kd | 5.42 | CHEMBL |
| ID | Source |
|---|---|
| 4019504 | VUID |
| N0000147624 | NUI |
| D00278 | KEGG_DRUG |
| 203021 | RXNORM |
| C0008996 | UMLSCUI |
| CHEBI:3749 | CHEBI |
| CHEMBL1292 | ChEMBL_ID |
| D002991 | MESH_DESCRIPTOR_UI |
| DB00845 | DRUGBANK_ID |
| 9184 | IUPHAR_LIGAND_ID |
| 2248 | INN_ID |
| D959AE5USF | UNII |
| 2794 | PUBCHEM_CID |
| 1685 | MMSL |
| 4473 | MMSL |
| d01121 | MMSL |
| 003007 | NDDF |
| 387410004 | SNOMEDCT_US |
| 72924009 | SNOMEDCT_US |
| 4019504 | VANDF |
None