Leukocyte adhesion glycoprotein LFA-1 alpha
Target ID: CHEMBL1803
Organism: Homo sapiens
Type: SINGLE PROTEIN
Molecules
| Name | SMILES | Bioactivity | Structure |
|---|---|---|---|
| EMETINE | CC[C@H]1CN2CCc3cc(OC)c(OC)cc3[C@@H]2C[C@@H]1C[C@H]1NCCc2cc(OC)c(OC)cc21 | IC50: 40.0 nM |  |
Top Fragments
| SMILES | Avg pKi | Count | Structure |
|---|---|---|---|
| [8*]CC | 7.4 | 16 |  |
| [15*][C@H]1C[C@H]2c3cc([16*])c([16*])cc3CCN2C[C@@H]1[15*] | 7.4 | 16 |  |
| [8*]C[C@H]1NCCc2cc([16*])c([16*])cc21 | 7.4 | 16 |  |
| [3*]OC | 7.4 | 16 |  |
| c1ccc2c(c1)CCN[C@@H]2C[C@@H]1CCN2CCc3ccccc3[C@@H]2C1 | 7.4 | 16 |  |