Molecule Details
| InChIKey | GRRDUDJQILRRES-HNNXBMFYSA-N |
|---|---|
| Compound Name | [4-[4-[[(2S)-thiiran-2-yl]methylsulfonyl]phenoxy]phenyl]methanamine |
| Canonical SMILES | NCc1ccc(Oc2ccc(S(=O)(=O)C[C@@H]3CS3)cc2)cc1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 7.14 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (3)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P08253 | MMP2 | Homo sapiens | Human | PF00040 PF00045 PF00413 | 7.4 | Ki | ChEMBL;BindingDB |
| P50281 | MMP14 | Homo sapiens | Human | PF11857 PF00045 PF00413 PF01471 | 7.3 | Ki | ChEMBL;BindingDB |
| P14780 | MMP9 | Homo sapiens | Human | PF00040 PF00045 PF00413 | 6.7 | Ki | ChEMBL;BindingDB |