Molecule Details
| InChIKey | VWBCONAHLFKQEK-QYTMHSNXSA-N |
|---|---|
| Canonical SMILES | CC1(C[C@]2(c3ccc(-c4cnn(C5CC5)c4)cc3)NC(=N)N([C@H](COC(=O)NC3(C(F)(F)F)CC3)c3ccc(Cl)c(-c4ncnn4C(F)F)c3)C2=O)CC1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 2 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 8.44 |
| 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 | 8.4 | IC50 | BindingDB |
| P04578 | env | Human immunodeficiency virus type 1 group M subtype B (isolate HXB2) | Pathogen | PF00516 PF00517 | 8.4 | IC50 | BindingDB |