Ras-related C3 botulinum toxin substrate 1
Target ID: CHEMBL6094
Organism: Homo sapiens
Type: SINGLE PROTEIN
Molecules
| Name | SMILES | Bioactivity | Structure |
|---|---|---|---|
| RUBOXISTAURIN | CN(C)C[C@@H]1CCn2cc(c3ccccc32)C2=C(C(=O)NC2=O)c2cn(c3ccccc23)CCO1 | IC50: 300.0 nM |  |
Top Fragments
| SMILES | Avg pKi | Count | Structure |
|---|---|---|---|
| [4*]C[8*] | 6.52 | 39 |  |
| [5*]N(C)C | 6.52 | 39 |  |
| O=C1NC(=O)C2=C1c1cn(c3ccccc13)CCCOCCn1cc2c2ccccc21 | 6.52 | 39 |  |
| [13*][C@@H]1CCn2cc(c3ccccc32)C2=C(C(=O)NC2=O)c2cn(c3ccccc23)CCO1 | 6.52 | 39 |  |