Molecule Details
| InChIKey | GVIPJIBLWRMISS-UHFFFAOYSA-N |
|---|---|
| Compound Name | 4-(3-Nitroanilino)-6-piperazin-1-yl-1,3,5-triazine-2-carbonitrile |
| Canonical SMILES | N#Cc1nc(Nc2cccc([N+](=O)[O-])c2)nc(N2CCNCC2)n1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 4 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 7.69 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (4)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P07711 | CTSL | Homo sapiens | Human | PF08246 PF00112 | 7.8 | IC50 | ChEMBL;BindingDB |
| P25774 | CTSS | Homo sapiens | Human | PF08246 PF00112 | 7.8 | IC50 | ChEMBL;BindingDB |
| P43235 | CTSK | Homo sapiens | Human | PF08246 PF00112 | 7.8 | IC50 | ChEMBL;BindingDB |
| P07858 | CTSB | Homo sapiens | Human | PF00112 PF08127 | 7.5 | IC50 | ChEMBL;BindingDB |