Molecule Details
| InChIKey | VLZYXSQGILGQAI-UHFFFAOYSA-N |
|---|---|
| Compound Name | 9-(3,5-Difluorophenyl)-6-(ethylamino)-2-purinecarbonitrile |
| Canonical SMILES | CCNc1nc(C#N)nc2c1ncn2-c1cc(F)cc(F)c1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 6 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 6.58 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (6)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P43235 | CTSK | Homo sapiens | Human | PF08246 PF00112 | 7.3 | IC50 | ChEMBL |
| P25774 | CTSS | Homo sapiens | Human | PF08246 PF00112 | 7.0 | IC50 | ChEMBL |
| Q9UBR2 | CTSZ | Homo sapiens | Human | PF00112 | 6.5 | IC50 | ChEMBL;BindingDB |
| P07711 | CTSL | Homo sapiens | Human | PF08246 PF00112 | 6.2 | IC50 | ChEMBL |
| P53634 | CTSC | Homo sapiens | Human | PF08773 PF00112 | 6.2 | IC50 | ChEMBL;BindingDB |
| P09668 | CTSH | Homo sapiens | Human | PF08246 PF00112 | 6.2 | IC50 | ChEMBL |