Molecule Details
| InChIKey | ASNREPVWGRJPSG-HUUCEWRRSA-N |
|---|---|
| Compound Name | (12R,16S)-13-propyl-3-oxa-13-azatetracyclo[7.7.0.02,6.012,16]hexadeca-1(9),2(6),4,7-tetraene |
| Canonical SMILES | CCCN1CC[C@H]2c3c(ccc4ccoc34)CC[C@H]21 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 5 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 7.08 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (5)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P08908 | HTR1A | Homo sapiens | Human | PF00001 | 8.4 | Ki | ChEMBL;BindingDB |
| P28223 | HTR2A | Homo sapiens | Human | PF00001 | 6.8 | Ki | ChEMBL;BindingDB |
| P28335 | HTR2C | Homo sapiens | Human | PF00001 | 6.8 | Ki | ChEMBL |
| P41595 | HTR2B | Homo sapiens | Human | PF00001 | 6.8 | Ki | ChEMBL |
| P35462 | DRD3 | Homo sapiens | Human | PF00001 | 6.5 | Ki | ChEMBL;BindingDB |