Molecule Details
| InChIKey | UBGUQYHIHIWAKK-UHFFFAOYSA-N |
|---|---|
| Compound Name | 2-(Cyclopentylsulfanyl)-6-[1-(2,6-difluorophenyl)ethyl]-5-methyl-3,4-dihydropyrimidin-4-one |
| Canonical SMILES | Cc1c(C(C)c2c(F)cccc2F)nc(SC2CCCC2)[nH]c1=O |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 7.71 |
| Source | BindingDB;ChEMBL |
2D Structure
Activity Profile
Target Activities (3)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P04585 | gag-pol | Human immunodeficiency virus type 1 group M subtype B (isolate HXB2) | Pathogen | PF00540 PF19317 PF00552 PF02022 PF00075 PF00665 PF00077 PF00078 PF06815 PF06817 PF00098 | 8.3 | IC50 | BindingDB |
| Q72547 | pol | Human immunodeficiency virus type 1 | Pathogen | PF00075 PF00078 PF06815 PF06817 | 7.8 | IC50 | ChEMBL;BindingDB |
| Q9WJQ2 | reverse transcriptase | Human immunodeficiency virus type 1 | Pathogen | PF00078 | 7.0 | Ki | BindingDB |