| Stem definition | Drug id | CAS RN |
|---|---|---|
| 3506 | 54-47-7 |
None
None
| Date | Agency | Company | Orphan |
|---|---|---|---|
| None | FDA |
None
None
None
None
| Source | Code | Description |
|---|---|---|
| ATC | A11HA06 | ALIMENTARY TRACT AND METABOLISM VITAMINS OTHER PLAIN VITAMIN PREPARATIONS Other plain vitamin preparations |
| 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 |
| CHEBI has role | CHEBI:23354 | coenzymes |
| CHEBI has role | CHEBI:131699 | EC 2.7.7.7 inhibitors |
None
None
None
| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 1.56 | acidic |
| pKa2 | 6.61 | acidic |
| pKa3 | 8.45 | acidic |
| pKa4 | 3.78 | Basic |
None
None
| Target | Class | Pharos | UniProt | Action | Type | Activity value (-log[M]) | Mechanism action | Bioact source | MoA source |
|---|---|---|---|---|---|---|---|---|---|
| P2X purinoceptor 1 | Ion channel | IC50 | 5 | CHEMBL | |||||
| Low molecular weight phosphotyrosine protein phosphatase | Enzyme | Ki | 4.89 | CHEMBL |
| ID | Source |
|---|---|
| 4024929 | VUID |
| N0000023490 | NUI |
| 41468-25-1 | SECONDARY_CAS_RN |
| 4024929 | VANDF |
| CHEBI:18405 | CHEBI |
| CHEBI:17310 | CHEBI |
| PLP | PDB_CHEM_ID |
| PXL | PDB_CHEM_ID |
| CHEMBL82202 | ChEMBL_ID |
| CHEMBL3181870 | ChEMBL_ID |
| 5249 | IUPHAR_LIGAND_ID |
| DB00114 | DRUGBANK_ID |
| 5V5IOJ8338 | UNII |
| 9002 | RXNORM |
| 227241 | MMSL |
| 30462 | MMSL |
| 327587 | MMSL |
| 003448 | NDDF |
| 019440 | NDDF |
| 259663004 | SNOMEDCT_US |
| 430926008 | SNOMEDCT_US |
| 770955002 | SNOMEDCT_US |
| C0034266 | UMLSCUI |
| D011732 | MESH_DESCRIPTOR_UI |
| C0034263 | UMLSCUI |
| DB00147 | DRUGBANK_ID |
| 1051 | PUBCHEM_CID |
| 66-72-8 | SECONDARY_CAS_RN |
| D011730 | MESH_DESCRIPTOR_UI |
| 1050 | PUBCHEM_CID |
None