Molecule Details
| InChIKey | DARQQJKHXPXSRO-QFIPXVFZSA-N |
|---|---|
| Compound Name | 6-[N-(1-Isopropyl-1,2,3,4-Tetrahydro-7-Isoquinolinyl)Carbamyl]-2-Naphthalenecarboxamidine |
| Canonical SMILES | CC(C)[C@@H]1NCCc2ccc(NC(=O)c3ccc4cc(C(=N)N)ccc4c3)cc21 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 4 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 6.96 |
| Source | BindingDB |
2D Structure
Activity Profile
DrugBank Annotations
| DrugBank ID | DB02705 |
|---|---|
| Drug Name | 6-[N-(1-Isopropyl-1,2,3,4-Tetrahydro-7-Isoquinolinyl)Carbamyl]-2-Naphthalenecarboxamidine |
| CAS Number | nan |
| Groups | experimental |
| ATC Codes | nan |
| Description | nan |
Cross-references: ChemSpider: 394749 PDB: 303 PubChem:447736 PubChem:46505769 ZINC: ZINC000026974275
Target Activities (4)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P00749 | PLAU | Homo sapiens | Human | PF00051 PF00089 | 7.6 | Ki | BindingDB |
| P07477 | PRSS1 | Homo sapiens | Human | PF00089 | 7.4 | Ki | BindingDB |
| P03952 | KLKB1 | Homo sapiens | Human | PF00024 PF00089 | 6.6 | Ki | BindingDB |
| P00747 | PLG | Homo sapiens | Human | PF00051 PF00024 PF00089 | 6.2 | Ki | BindingDB |
DrugBank Target Actions (1)
| Target | Gene | Target Name | Action | Type |
|---|---|---|---|---|
| P00749 | PLAU | Urokinase-type plasminogen activator | binder | targets |