Molecule Details
| InChIKey | ATHGHQPFGPMSJY-UHFFFAOYSA-N |
|---|---|
| Compound Name | Spermidine |
| Canonical SMILES | NCCCCNCCCN |
| Clinical Status | Clinical Multi-Target |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 6.47 |
| Source | ChEMBL;BindingDB;TTD_MultiTarget |
2D Structure
Activity Profile
DrugBank Annotations
| DrugBank ID | DB03566 |
|---|---|
| Drug Name | Spermidine |
| CAS Number | 124-20-9 |
| Groups | investigational |
| ATC Codes | nan |
| Description | Spermidine is a polyamine formed from putrescine. It is found in almost all tissues in association with nucleic acids. It is found as a cation at all pH values, and is thought to help stabilize some membranes and nucleic acid structures. It is a precursor of spermine. |
Categories: Amines Biogenic Amines Biogenic Polyamines OCT1 substrates Polyamines
Cross-references: BindingDB: 50009353 ChEBI: 16610 CHEMBL19612 ChemSpider: 1071 Guide to Pharmacology: 2390 IUPHAR: 2390 C00315 PDB: SPD PubChem:1102 PubChem:46506086 RxCUI: 1483262 Wikipedia: Spermidine ZINC: ZINC000001532612
Target Activities (3)
DrugBank Target Actions (7)
| Target | Gene | Target Name | Action | Type |
|---|---|---|---|---|
| P07550 | ADRB2 | Beta-2 adrenergic receptor | binder | targets |
| P08588 | ADRB1 | Beta-1 adrenergic receptor | binder | targets |
| P0AFK9 | P0AFK9 | Spermidine/putrescine-binding periplasmic protein | binder | targets |
| P23181 | P23181 | Gentamicin 3-N-acetyltransferase | binder | targets |
| Q16881 | TXNRD1 | Thioredoxin reductase 1, cytoplasmic | inhibitor | targets |
| Q9H015 | Q9H015 | Solute carrier family 22 member 4 | inhibitor | transporters |
| O15245 | SLC22A1 | Solute carrier family 22 member 1 | substrate | transporters |