Stem definition | Drug id | CAS RN |
---|---|---|
antimicrobials, dihydrofolate reductase (DHFR) inhibitors, trimethoprim analogues | 398 | 56518-41-3 |
Molecule | Description |
---|---|
Synonyms:
|
inhibits dihydrofolate reductase
|
Dose | Unit | Route |
---|---|---|
0.20 | g | O |
Property | Value | Reference |
---|---|---|
MRTD (Maximum Recommended Therapeutic Daily Dose) | 9.27 ยตM/kg/day | Contrera JF, Matthews EJ, Kruhlak NL, Benz RD |
Date | Agency | Company | Orphan |
---|---|---|---|
Jan. 1, 1993 | YEAR INTRODUCED |
None
None
None
None
Source | Code | Description |
---|---|---|
ATC | J01EA02 | ANTIINFECTIVES FOR SYSTEMIC USE ANTIBACTERIALS FOR SYSTEMIC USE SULFONAMIDES AND TRIMETHOPRIM Trimethoprim and derivatives |
MeSH PA | D000890 | Anti-Infective Agents |
MeSH PA | D004791 | Enzyme Inhibitors |
MeSH PA | D005493 | Folic Acid Antagonists |
CHEBI has role | CHEBI:35441 | antiinfective agents |
CHEBI has role | CHEBI:36047 | antibacterial drugs |
CHEBI has role | CHEBI:50683 | dihydrofolic acid reductase inhibitors |
None
None
None
Dissociation level | Dissociation constant | Type (acidic/basic) |
---|---|---|
pKa1 | 7.01 | Basic |
pKa2 | 0.6 | Basic |
None
None
Target | Class | Pharos | UniProt | Action | Type | Activity value (-log[M]) | Mechanism action | Bioact source | MoA source |
---|---|---|---|---|---|---|---|---|---|
Bifunctional dihydrofolate reductase-thymidylate synthase | Enzyme | IC50 | 7.77 | CHEMBL | |||||
Dihydrofolate reductase | Enzyme | IC50 | 7.51 | CHEMBL | |||||
Dihydrofolate reductase | Enzyme | IC50 | 7.82 | CHEMBL | |||||
Dihydrofolate reductase | Enzyme | Ki | 8.18 | WOMBAT-PK | |||||
Dihydrofolate reductase | Enzyme | Ki | 7.95 | CHEMBL | |||||
Dihydrofolate reductase | Enzyme | Ki | 4.54 | CHEMBL | |||||
Dihydrofolate reductase | Enzyme | IC50 | 8.53 | CHEMBL | |||||
Dihydrofolate reductase | Enzyme | Ki | 8.18 | CHEMBL |
ID | Source |
---|---|
D07238 | KEGG_DRUG |
19727 | RXNORM |
C0054084 | UMLSCUI |
CHEBI:131726 | CHEBI |
CHEMBL31891 | ChEMBL_ID |
DB13795 | DRUGBANK_ID |
C037079 | MESH_SUPPLEMENTAL_RECORD_UI |
68760 | PUBCHEM_CID |
12325 | IUPHAR_LIGAND_ID |
4910 | INN_ID |
V1YC7T6LLI | UNII |
006013 | NDDF |
None