Coagulation factor XI
Target ID: CHEMBL2820
Organism: Homo sapiens
Type: SINGLE PROTEIN
Molecules
| Name | SMILES | Bioactivity | Structure |
|---|---|---|---|
| MELAGATRAN | N=C(N)c1ccc(CNC(=O)[C@@H]2CCN2C(=O)[C@H](NCC(=O)O)C2CCCCC2)cc1 | IC50: 4700.0 nM |  |
| RAZAXABAN | CN(C)Cc1nccn1-c1ccc(NC(=O)c2cc(C(F)(F)F)nn2-c2ccc3onc(N)c3c2)c(F)c1 | Ki: 0.19 nM |  |
Top Fragments
| SMILES | Avg pKi | Count | Structure |
|---|---|---|---|
| [5*]N[5*] | 7.09 | 65 |  |
| [4*]C[8*] | 7.09 | 65 |  |
| [1*]C([6*])=O | 7.09 | 65 |  |
| [15*]C1CCCCC1 | 5.33 | 39 |  |
| [1*]C(=O)[C@H]([4*])[8*] | 5.33 | 39 |  |