| Stem definition | Drug id | CAS RN |
|---|---|---|
| 3535 | 153-18-4 |
None
None
None
None
None
None
None
| Source | Code | Description |
|---|---|---|
| ATC | C05CA01 | CARDIOVASCULAR SYSTEM VASOPROTECTIVES CAPILLARY STABILIZING AGENTS Bioflavonoids |
| ATC | C05CA51 | CARDIOVASCULAR SYSTEM VASOPROTECTIVES CAPILLARY STABILIZING AGENTS Bioflavonoids |
| CHEBI has role | CHEBI:22586 | antioxidants |
| CHEBI has role | CHEBI:25212 | metabolites |
| Disease | Relation | SNOMED_ID | DOID |
|---|---|---|---|
| Ascorbic acid deficiency | indication | 76169001 | |
| Methemoglobinemia | off-label use | 38959009 | DOID:10783 |
| Primary hyperoxaluria | contraindication | 17901006 | DOID:2977 |
| Anemia due to enzyme deficiency | contraindication | 111577008 | |
| Hb SS disease | contraindication | 127040003 | DOID:10923 |
| Hemochromatosis | contraindication | 399187006 | DOID:2352 |
None
None
| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 5.66 | acidic |
| pKa2 | 8.12 | acidic |
| pKa3 | 9.13 | acidic |
| pKa4 | 11.35 | acidic |
| pKa5 | 12.8 | acidic |
| pKa6 | 13.49 | acidic |
None
None
| Target | Class | Pharos | UniProt | Action | Type | Activity value (-log[M]) | Mechanism action | Bioact source | MoA source |
|---|---|---|---|---|---|---|---|---|---|
| Alpha-2A adrenergic receptor | GPCR | Ki | 5.03 | CHEMBL | |||||
| Muscarinic acetylcholine receptor M5 | GPCR | Ki | 7.45 | PDSP | |||||
| Alpha-2C adrenergic receptor | GPCR | Ki | 5.02 | CHEMBL | |||||
| Acetylcholinesterase | Enzyme | IC50 | 7.92 | CHEMBL | |||||
| Xanthine dehydrogenase/oxidase | Enzyme | IC50 | 4.28 | CHEMBL | |||||
| Cystic fibrosis transmembrane conductance regulator | Ion channel | Kd | 4.18 | CHEMBL | |||||
| Bifunctional epoxide hydrolase 2 | Enzyme | IC50 | 4.61 | CHEMBL | |||||
| Lysine-specific histone demethylase 1A | Enzyme | IC50 | 5.67 | CHEMBL | |||||
| Neuromedin-U receptor 2 | GPCR | EC50 | 5.92 | CHEMBL | |||||
| Aldose reductase | Enzyme | IC50 | 4.89 | CHEMBL | |||||
| Polyphenol oxidase 2 | Enzyme | IC50 | 4.16 | CHEMBL | |||||
| Serum albumin | Secreted | IC50 | 4.38 | CHEMBL | |||||
| Neuraminidase | Enzyme | Ki | 4.47 | CHEMBL | |||||
| Sialidase | Enzyme | IC50 | 4.51 | CHEMBL | |||||
| Neuraminidase | Enzyme | IC50 | 4.02 | CHEMBL |
| ID | Source |
|---|---|
| 4018980 | VUID |
| N0000147257 | NUI |
| D08499 | KEGG_DRUG |
| 4018980 | VANDF |
| C0035976 | UMLSCUI |
| CHEBI:28527 | CHEBI |
| RUT | PDB_CHEM_ID |
| CHEMBL226335 | ChEMBL_ID |
| DB01698 | DRUGBANK_ID |
| C404204 | MESH_SUPPLEMENTAL_RECORD_UI |
| 5280805 | PUBCHEM_CID |
| 9500 | RXNORM |
| 136910 | MMSL |
| NOCODE | MMSL |
| 001034 | NDDF |
| 126145002 | SNOMEDCT_US |
| 68077006 | SNOMEDCT_US |
| D012431 | MESH_DESCRIPTOR_UI |
| 2213 | INN_ID |
| 5G06TVY3R7 | UNII |
| Product | Category | Ingredients | NDC | Form | Quantity | Route | Marketing | Label |
|---|---|---|---|---|---|---|---|---|
| Dairy Allergen Mix | HUMAN OTC DRUG LABEL | 38 | 43742-1277 | LIQUID | 6 [hp_X] | ORAL | unapproved drug other | 9 sections |