Molecule Details
| InChIKey | RUWAWICLBRNNBY-UHFFFAOYSA-N |
|---|---|
| Compound Name | 4-methyl-N-(5-piperazin-1-yl-2-pyridinyl)-3-propan-2-yl-8-oxa-4,5,11,13-tetrazatricyclo[7.4.0.02,6]trideca-1(13),2,5,9,11-pentaen-12-amine |
| Canonical SMILES | CC(C)c1c2c(nn1C)COc1cnc(Nc3ccc(N4CCNCC4)cn3)nc1-2 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 4 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 7.0 |
| Source | BindingDB;ChEMBL |
2D Structure
Activity Profile
Target Activities (4)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P11802 | CDK4 | Homo sapiens | Human | PF00069 | 8.1 | IC50 | ChEMBL;BindingDB |
| P24385 | CCND1 | Homo sapiens | Human | PF02984 PF00134 | 7.8 | IC50 | ChEMBL;BindingDB |
| P24941 | CDK2 | Homo sapiens | Human | PF00069 | 6.1 | IC50 | BindingDB |
| P06493 | CDK1 | Homo sapiens | Human | PF00069 | 6.1 | IC50 | BindingDB |