Molecule Details
| InChIKey | IJIGRXABGQBDBA-QWHCGFSZSA-N |
|---|---|
| Compound Name | US11014911, Example 15 |
| Canonical SMILES | Cc1cc(CC(=O)Nc2cc([C@H]3CC[C@@H](OC(=O)NC4(C)CC4)C3)[nH]n2)on1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 10 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 8.11 |
| Source | BindingDB;ChEMBL |
2D Structure
Activity Profile
Target Activities (10)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P24864 | CCNE1 | Homo sapiens | Human | PF02984 PF00134 | 9.8 | Ki | ChEMBL |
| P24941 | CDK2 | Homo sapiens | Human | PF00069 | 9.8 | Ki | ChEMBL;BindingDB |
| P50750 | CDK9 | Homo sapiens | Human | PF00069 | 8.2 | Ki | ChEMBL;BindingDB |
| P51946 | CCNH | Homo sapiens | Human | PF16899 PF00134 | 8.2 | Ki | BindingDB |
| P06493 | CDK1 | Homo sapiens | Human | PF00069 | 7.8 | Ki | ChEMBL;BindingDB |
| P20248 | CCNA2 | Homo sapiens | Human | PF02984 PF00134 PF16500 | 7.8 | Ki | ChEMBL |
| P11802 | CDK4 | Homo sapiens | Human | PF00069 | 7.6 | Ki | ChEMBL;BindingDB |
| P49841 | GSK3B | Homo sapiens | Human | PF00069 | 7.5 | Ki | ChEMBL;BindingDB |
| P24385 | CCND1 | Homo sapiens | Human | PF02984 PF00134 | 7.2 | Ki | ChEMBL;BindingDB |
| Q00534 | CDK6 | Homo sapiens | Human | PF00069 | 7.2 | Ki | ChEMBL;BindingDB |