Target ID: CHEMBL5403
Organism: Homo sapiens
Type: SINGLE PROTEIN
| Name | SMILES | Bioactivity | Structure |
|---|---|---|---|
| TOFACITINIB | C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1ncnc2[nH]ccc12 | IC50: 13.0 nM | ![]() |
| SORAFENIB | CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)cc2)ccn1 | IC50: 12.0 nM | ![]() |
| SMILES | Avg pKi | Count | Structure |
|---|---|---|---|
| [5*]N1CC[C@@H](C)[C@@H]([15*])C1 | 7.89 | 39 | ![]() |
| [14*]c1ncnc2[nH]ccc12 | 7.89 | 39 | ![]() |
| [5*]N([5*])C | 7.89 | 39 | ![]() |
| [1*]C(=O)CC#N | 7.89 | 39 | ![]() |
| c1nc(N[C@@H]2CCCNC2)c2cc[nH]c2n1 | 7.89 | 39 | ![]() |