Molecule Details
| InChIKey | OVBPIULPVIDEAO-LBPRGKRZSA-N |
|---|---|
| Canonical SMILES | Nc1nc2ncc(CNc3ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc3)nc2c(=O)[nH]1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 2 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 6.09 |
| Source | BindingDB;ChEMBL |
2D Structure
Activity Profile
DrugBank Annotations
| DrugBank ID | DB00158 |
|---|---|
| Drug Name | Folic acid |
| CAS Number | 59-30-3 |
| Groups | approved investigational nutraceutical vet_approved |
| ATC Codes | B03AE02 B03AD04 V04CX02 B03AD01 B03BB51 B03AD03 B03BB01 B03AE01 B03AD05 B03AD02 |
| Description | Folic acid, also known as folate or Vitamin B9, is a member of the B vitamin family and an essential cofactor for enzymes involved in DNA and RNA synthesis. More specifically, folic acid is required by the body for the synthesis of purines, pyrimidines, and methionine before incorporation into DNA o... |
Categories: Antianemic Preparations Autacoids BCRP/ABCG2 Substrates Biological Factors Diagnostic Agents Diet, Food, and Nutrition Dietary Supplements Drugs that are Mainly Renally Excreted Folic Acid and Derivatives Food Growth Substances Hematinics Hematologic Agents Heterocyclic Compounds, Fused-Ring Micronutrients OAT1/SLC22A6 inhibitors Pteridines Pterins Supplements Vitamin B Complex Vitamin B12 and Folic Acid Vitamins
Cross-references: BindingDB: 50367343 ChEBI: 27470 CHEMBL1622 ChemSpider: 5815 Drugs Product Database (DPD): 4991 C00504 D00070 PDB: FOL PharmGKB: PA449692 PubChem:6037 PubChem:46508092 RxCUI: 4511 Therapeutic Targets Database: DAP001309 Wikipedia: Folate ZINC: ZINC000008577218
Target Activities (2)
DrugBank Target Actions (15)
| Target | Gene | Target Name | Action | Type |
|---|---|---|---|---|
| P00374 | DHFR | Dihydrofolate reductase | substrate | enzymes |
| P42898 | P42898 | Methylenetetrahydrofolate reductase (NADPH) | substrate | enzymes |
| Q92820 | Q92820 | Gamma-glutamyl hydrolase | substrate | enzymes |
| P14207 | FOLR2 | Folate receptor beta | binder | targets |
| P15328 | FOLR1 | Folate receptor alpha | binder | targets |
| P41439 | P41439 | Folate receptor gamma | binder | targets |
| P41440 | SLC19A1 | Reduced folate transporter | modulator | targets |
| Q96NT5 | SLC46A1 | Proton-coupled folate transporter | modulator | targets |
| O15439 | O15439 | ATP-binding cassette sub-family C member 4 | inhibitor | transporters |
| Q4U2R8 | SLC22A6 | Solute carrier family 22 member 6 | inhibitor | transporters |
| O15438 | ABCC3 | ATP-binding cassette sub-family C member 3 | substrate | transporters |
| Q96J66 | Q96J66 | ATP-binding cassette sub-family C member 11 | substrate | transporters |
| Q96NT5 | SLC46A1 | Proton-coupled folate transporter | substrate | transporters |
| Q9H2D1 | Q9H2D1 | Solute carrier family 25 member 32 | substrate | transporters |
| Q9UNQ0 | ABCG2 | Broad substrate specificity ATP-binding cassette transporter ABCG2 | substrate | transporters |