Molecule Details
| InChIKey | UYZFAUAYFLEHRC-LURJTMIESA-N |
|---|---|
| Compound Name | N5-(1-iminoethyl)-L-ornithine |
| Canonical SMILES | CC(=N)NCCC[C@H](N)C(=O)O |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 6.4 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
DrugBank Annotations
| DrugBank ID | DB03305 |
|---|---|
| Drug Name | N(G)-Iminoethylornithine |
| CAS Number | 36889-13-1 |
| Groups | experimental |
| ATC Codes | nan |
| Description | nan |
Categories: Amino Acids Amino Acids, Basic Amino Acids, Diamino Amino Acids, Peptides, and Proteins Enzyme Inhibitors Nitric Oxide Synthase, antagonists & inhibitors
Cross-references: BindingDB: 50072297 ChEBI: 192723 CHEMBL11471 ChemSpider: 97098 PDB: ILO PubChem:107984 PubChem:46507343 ZINC: ZINC000001886324
Target Activities (3)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P29475 | NOS1 | Homo sapiens | Human | PF00667 PF00258 PF00175 PF02898 PF00595 | 6.6 | Ki | ChEMBL;BindingDB |
| P35228 | NOS2 | Homo sapiens | Human | PF00667 PF00258 PF00175 PF02898 | 6.5 | Ki | ChEMBL;BindingDB |
| P29474 | NOS3 | Homo sapiens | Human | PF00667 PF00258 PF00175 PF02898 | 6.1 | Ki | ChEMBL;BindingDB |