Molecule Details
| InChIKey | LJKWPNDKPDWWIA-VWNVYAMZSA-N |
|---|---|
| Canonical SMILES | [C][C]([C])[C@H]1C(=O)[N][C@@H]([C][C][C]N=C([N])[N])C(=O)[N][C]C(=O)[N][C@@H]([C]C([O])=O)C(=O)[N][C@H]([C]c2ccccc2)C(=O)N1[C] |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 4 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 8.61 |
| Source | BindingDB |
2D Structure
Activity Profile
Target Activities (4)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P05106 | ITGB3 | Homo sapiens | Human | PF07974 PF23105 PF18372 PF08725 PF07965 PF00362 PF17205 | 9.1 | IC50 | BindingDB |
| P06756 | ITGAV | Homo sapiens | Human | PF01839 PF08441 PF20805 PF20806 PF00357 | 8.8 | IC50 | BindingDB |
| P18084 | ITGB5 | Homo sapiens | Human | PF23105 PF18372 PF08725 PF07965 PF00362 PF17205 | 8.7 | IC50 | BindingDB |
| P08648 | ITGA5 | Homo sapiens | Human | PF01839 PF08441 PF20805 PF20806 | 7.8 | IC50 | BindingDB |