Stem definition | Drug id | CAS RN |
---|---|---|
4134 | 65-22-5 |
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 |
---|---|---|---|---|---|---|
Hepatic function abnormal | 68.17 | 43.81 | 21 | 511 | 37121 | 63451369 |
Osteonecrosis of jaw | 44.47 | 43.81 | 15 | 517 | 35108 | 63453382 |
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 |
---|---|---|---|---|---|---|
Interstitial lung disease | 59.04 | 41.18 | 24 | 405 | 65258 | 34891244 |
Hepatic function abnormal | 42.37 | 41.18 | 17 | 412 | 44346 | 34912156 |
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 |
---|---|---|---|---|---|---|
Hepatic function abnormal | 91.90 | 32.95 | 36 | 1140 | 73071 | 79670141 |
Interstitial lung disease | 86.36 | 32.95 | 39 | 1137 | 112561 | 79630651 |
Palmar-plantar erythrodysaesthesia syndrome | 58.64 | 32.95 | 21 | 1155 | 33113 | 79710099 |
Osteonecrosis of jaw | 39.57 | 32.95 | 17 | 1159 | 43209 | 79700003 |
Platelet count decreased | 38.92 | 32.95 | 28 | 1148 | 194636 | 79548576 |
None
Source | Code | Description |
---|---|---|
MeSH PA | D018977 | Micronutrients |
MeSH PA | D014803 | Vitamin B Complex |
MeSH PA | D014815 | Vitamins |
CHEBI has role | CHEBI:23357 | cofactor |
CHEBI has role | CHEBI:75771 | Mus musculus metabolites |
CHEBI has role | CHEBI:75772 | S. cerevisiae metabolites |
CHEBI has role | CHEBI:76971 | Escherichia coli metabolites |
CHEBI has role | CHEBI:77746 | Homo sapiens metabolite |
None
None
None
Dissociation level | Dissociation constant | Type (acidic/basic) |
---|---|---|
pKa1 | 7.59 | acidic |
pKa2 | 12.8 | acidic |
pKa3 | 4.21 | Basic |
None
None
Target | Class | Pharos | UniProt | Action | Type | Activity value (-log[M]) | Mechanism action | Bioact source | MoA source |
---|---|---|---|---|---|---|---|---|---|
Aldehyde oxidase | Enzyme | Ki | 4.52 | CHEMBL |
ID | Source |
---|---|
3THM379K8A | UNII |
N0000008146 | NUI |
C0034263 | UMLSCUI |
CHEBI:17310 | CHEBI |
PXL | PDB_CHEM_ID |
CHEMBL102970 | ChEMBL_ID |
1050 | PUBCHEM_CID |
DB00147 | DRUGBANK_ID |
D011730 | MESH_DESCRIPTOR_UI |
9002 | RXNORM |
019440 | NDDF |
430926008 | SNOMEDCT_US |
770955002 | SNOMEDCT_US |
66-72-8 | SECONDARY_CAS_RN |
None