Molecule Details
| InChIKey | LUZRJRNZXALNLM-YCFDMHLDSA-N |
|---|---|
| Compound Name | 7-Methyl-4,6,6a,7,8,9,10,10a-octahydro-indolo[4,3-fg]quinoline-9-carboxylic acid ((2R,5S,10bS)-5-benzyl-10b-hydroxy-2-methyl-3,6-dioxo-octahydro-oxazolo[3,2-a]pyrrolo[2,1-c]pyrazin-2-yl)-amide |
| Canonical SMILES | CN1CC(C(=O)N[C@]2(C)O[C@@]3(O)C4CCCN4C(=O)[C@H](Cc4ccccc4)N3C2=O)CC2c3cccc4[nH]cc(c34)CC21 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 7 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 8.63 |
| Source | BindingDB |
2D Structure
Activity Profile
Target Activities (7)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P28221 | HTR1D | Homo sapiens | Human | PF00001 | 9.9 | Ki | BindingDB |
| P28222 | HTR1B | Homo sapiens | Human | PF00001 | 9.3 | Ki | BindingDB |
| P08908 | HTR1A | Homo sapiens | Human | PF00001 | 8.8 | Ki | BindingDB |
| P14416 | DRD2 | Homo sapiens | Human | PF00001 | 8.3 | Ki | BindingDB |
| P50406 | HTR6 | Homo sapiens | Human | PF00001 | 8.3 | Ki | BindingDB |
| P34969 | HTR7 | Homo sapiens | Human | PF00001 | 8.0 | Ki | BindingDB |
| P35462 | DRD3 | Homo sapiens | Human | PF00001 | 7.8 | Ki | BindingDB |