Molecule Details
| InChIKey | XBXCMGXDWHDVNX-QDPGVEIFSA-N |
|---|---|
| Canonical SMILES | CC(C)(C)C[C@]1(c2ccc(-c3cnn(C(F)F)c3)cc2)NC(=N)N([C@H](CO)c2ccc(Cl)c(-n3cncn3)c2)C1=O |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 2 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 7.79 |
| Source | BindingDB |
2D Structure
Activity Profile
Target Activities (2)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P03366 | gag-pol | Human immunodeficiency virus type 1 group M subtype B (isolate BH10) | Pathogen | PF00540 PF19317 PF00552 PF02022 PF00075 PF00665 PF00077 PF00078 PF06815 PF06817 PF00098 | 7.8 | IC50 | BindingDB |
| P04578 | env | Human immunodeficiency virus type 1 group M subtype B (isolate HXB2) | Pathogen | PF00516 PF00517 | 7.8 | IC50 | BindingDB |