Molecule Details
| InChIKey | YTWMOTHGBHTPOA-UHFFFAOYSA-N |
|---|---|
| Compound Name | 8-[4-[(4-Fluorophenyl)methyl]piperazin-1-yl]-5-thia-1,7-diazatricyclo[7.3.0.02,6]dodeca-2(6),3,7,9,11-pentaene |
| Canonical SMILES | Fc1ccc(CN2CCN(c3nc4sccc4n4cccc34)CC2)cc1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 5 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 8.93 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (5)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| A5X5Y0 | HTR3E | Homo sapiens | Human | PF02931 PF02932 | 8.9 | IC50 | ChEMBL |
| O95264 | HTR3B | Homo sapiens | Human | PF02931 PF02932 | 8.9 | IC50 | ChEMBL |
| P46098 | HTR3A | Homo sapiens | Human | PF02931 PF02932 | 8.9 | IC50 | ChEMBL;BindingDB |
| Q70Z44 | HTR3D | Homo sapiens | Human | PF02931 PF02932 | 8.9 | IC50 | ChEMBL |
| Q8WXA8 | HTR3C | Homo sapiens | Human | PF02931 PF02932 | 8.9 | IC50 | ChEMBL |