Molecule Details
| InChIKey | OICCEQGFJHNAPZ-UHFFFAOYSA-N |
|---|---|
| Compound Name | N-(5-(7''-Fluoro-3''-methyl-2''-oxo-2'',3''-dihydrospiro[cyclobutane-1,1''-pyrrolo[2,3-c]quinolin]-8''-yl)-2-(2-(isopropylamino)ethoxy)pyridin-3-yl)propane-2-sulfonamide |
| Canonical SMILES | CC(C)NCCOC1=NCC(C2=CC3C4=C(C=NC3CC2F)N(C)C(=O)C42CCC2)C=C1NS(=O)(=O)C(C)C |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 8.04 |
| Source | BindingDB |
2D Structure
Activity Profile
Target Activities (3)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P78527 | PRKDC | Homo sapiens | Human | PF20500 PF20502 PF08163 PF19704 PF02259 PF02260 PF00454 | 9.1 | IC50 | BindingDB |
| P42336 | PIK3CA | Homo sapiens | Human | PF00454 PF00792 PF02192 PF00794 PF00613 | 7.7 | IC50 | BindingDB |
| O00329 | PIK3CD | Homo sapiens | Human | PF00454 PF00792 PF02192 PF00794 PF00613 | 7.3 | IC50 | BindingDB |