| Stem definition | Drug id | CAS RN |
|---|---|---|
| 4731 | 602-41-5 |
None
None
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 |
|---|---|---|---|---|---|---|
| Poisoning deliberate | 65.34 | 42.94 | 18 | 781 | 7826 | 34948306 |
| 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 |
|---|---|---|---|---|---|---|
| Poisoning deliberate | 53.83 | 39.20 | 19 | 1771 | 18809 | 79723789 |
| Palatal oedema | 47.47 | 39.20 | 10 | 1780 | 1421 | 79741177 |
| Melaena | 46.29 | 39.20 | 24 | 1766 | 60866 | 79681732 |
| Urticaria | 46.16 | 39.20 | 36 | 1754 | 185165 | 79557433 |
| Erythema | 42.27 | 39.20 | 37 | 1753 | 223253 | 79519345 |
| Hepatocellular injury | 39.76 | 39.20 | 20 | 1770 | 47573 | 79695025 |
None
| Source | Code | Description |
|---|---|---|
| ATC | M03BX05 | MUSCULO-SKELETAL SYSTEM MUSCLE RELAXANTS MUSCLE RELAXANTS, CENTRALLY ACTING AGENTS Other centrally acting agents |
| ATC | M03BX55 | MUSCULO-SKELETAL SYSTEM MUSCLE RELAXANTS MUSCLE RELAXANTS, CENTRALLY ACTING AGENTS Other centrally acting agents |
| Disease | Relation | SNOMED_ID | DOID |
|---|---|---|---|
| Spasticity | indication | 221360009 |
None
None
| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 12.22 | acidic |
| pKa2 | 12.23 | acidic |
| pKa3 | 12.92 | acidic |
| pKa4 | 13.44 | acidic |
None
None
| Target | Class | Pharos | UniProt | Action | Type | Activity value (-log[M]) | Mechanism action | Bioact source | MoA source |
|---|---|---|---|---|---|---|---|---|---|
| GABA-A receptor alpha-1/beta-2/gamma-2 | Ion channel | NEGATIVE MODULATOR | IC50 | 6.70 | SCIENTIFIC LITERATURE | ||||
| GABA A receptor alpha-2/beta-2/gamma-2 | Ion channel | NEGATIVE MODULATOR | IC50 | 6.89 | SCIENTIFIC LITERATURE | ||||
| GABA A receptor alpha-1/beta-1/gamma-2 | Ion channel | NEGATIVE MODULATOR | IC50 | 6.82 | SCIENTIFIC LITERATURE | ||||
| GABA-A receptor; anion channel | Ion channel | IC50 | 5.72 | CHEMBL |
| ID | Source |
|---|---|
| D07276 | KEGG_DRUG |
| CHEBI:94557 | CHEBI |
| CHEMBL1705373 | ChEMBL_ID |
| C004280 | MESH_SUPPLEMENTAL_RECORD_UI |
| 671 | INN_ID |
| DB11582 | DRUGBANK_ID |
| T1X8S697GT | UNII |
| 38085 | RXNORM |
| 005350 | NDDF |
| 1173015002 | SNOMEDCT_US |
| 735241007 | SNOMEDCT_US |
| C0076456 | UMLSCUI |
| 9915886 | PUBCHEM_CID |
None