Molecule Details
| InChIKey | NNEGEHDJOHHIGP-UHFFFAOYSA-N |
|---|---|
| Compound Name | 4-[4-[6-(5-Fluoro-2-methoxy-4-pyridinyl)-3-(2-pyrrolidin-1-ylethylamino)-2-pyridinyl]piperidin-1-yl]-5-methyl-5,7-dihydropyrrolo[2,3-d]pyrimidin-6-one |
| Canonical SMILES | COc1cc(-c2ccc(NCCN3CCCC3)c(C3CCN(c4ncnc5c4C(C)C(=O)N5)CC3)n2)c(F)cn1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 8.99 |
| Source | BindingDB;ChEMBL |
2D Structure
Activity Profile
Target Activities (3)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P31749 | AKT1 | Homo sapiens | Human | PF00169 PF00069 PF00433 | 9.2 | IC50 | ChEMBL;BindingDB |
| P21817 | RYR1 | Homo sapiens | Human | PF08709 PF00520 PF02815 PF08454 PF06459 PF01365 PF21119 PF02026 PF00622 | 9.1 | IC50 | BindingDB |
| Q15418 | RPS6KA1 | Homo sapiens | Human | PF00069 PF00433 | 8.7 | IC50 | ChEMBL;BindingDB |