| Stem definition | Drug id | CAS RN |
|---|---|---|
| 2314 | 14222-60-7 |
| Dose | Unit | Route |
|---|---|---|
| 0.75 | g | O |
| Property | Value | Reference |
|---|---|---|
| BA (Bioavailability) | 99 % | Kim MT, Sedykh A, Chakravarti SK, Saiakhov RD, Zhu H |
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 |
|---|---|---|---|---|---|---|
| Electrocardiogram QT prolonged | 81.68 | 43.86 | 24 | 305 | 59506 | 63429187 |
| Hepatotoxicity | 78.46 | 43.86 | 21 | 308 | 37020 | 63451673 |
| Drug resistance | 48.41 | 43.86 | 13 | 316 | 22920 | 63465773 |
| 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 |
|---|---|---|---|---|---|---|
| Hepatotoxicity | 240.84 | 53.00 | 60 | 623 | 21425 | 34934823 |
| Electrocardiogram QT prolonged | 122.41 | 53.00 | 41 | 642 | 40911 | 34915337 |
| 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 |
|---|---|---|---|---|---|---|
| Hepatotoxicity | 306.22 | 44.71 | 81 | 1024 | 51271 | 79692012 |
| Electrocardiogram QT prolonged | 190.83 | 44.71 | 64 | 1041 | 90322 | 79652961 |
| Drug resistance | 58.59 | 44.71 | 22 | 1083 | 42191 | 79701092 |
None
| Source | Code | Description |
|---|---|---|
| ATC | J04AD01 | ANTIINFECTIVES FOR SYSTEMIC USE ANTIMYCOBACTERIALS DRUGS FOR TREATMENT OF TUBERCULOSIS Thiocarbamide derivatives |
| MeSH PA | D000900 | Anti-Bacterial Agents |
| MeSH PA | D000890 | Anti-Infective Agents |
| MeSH PA | D000995 | Antitubercular Agents |
None
None
None
| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 11.43 | acidic |
| pKa2 | 5.65 | Basic |
None
None
| Target | Class | Pharos | UniProt | Action | Type | Activity value (-log[M]) | Mechanism action | Bioact source | MoA source |
|---|---|---|---|---|---|---|---|---|---|
| Polyphenol oxidase 2 | Enzyme | IC50 | 5.35 | CHEMBL |
| ID | Source |
|---|---|
| N0000167317 | NUI |
| D01195 | KEGG_DRUG |
| C0033705 | UMLSCUI |
| CHEBI:32066 | CHEBI |
| CHEMBL1378024 | ChEMBL_ID |
| DB12667 | DRUGBANK_ID |
| 2031 | INN_ID |
| 76YOO33643 | UNII |
| 666418 | PUBCHEM_CID |
| 8871 | RXNORM |
| 006706 | NDDF |
| 703589003 | SNOMEDCT_US |
| 714517006 | SNOMEDCT_US |
| D011515 | MESH_DESCRIPTOR_UI |
None