Target ID: CHEMBL2457
Organism: Homo sapiens
Type: SINGLE PROTEIN
| Name | SMILES | Bioactivity | Structure |
|---|---|---|---|
| BAICALEIN | O=c1cc(-c2ccccc2)oc2cc(O)c(O)c(O)c12 | Inhibition: 57.0 % | ![]() |
| QUERCETIN | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | IC50: 32870.0 nM | ![]() |
| GEFITINIB | COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1 | IC50: 515.0 nM | ![]() |
| DIPYRIDAMOLE | OCCN(CCO)c1nc(N2CCCCC2)c2nc(N(CCO)CCO)nc(N3CCCCC3)c2n1 | IC50: 500.0 nM | ![]() |
| SMILES | Avg pKi | Count | Structure |
|---|---|---|---|
| O=c1cc(-c2ccccc2)oc2ccccc12 | 4.48 | 78 | ![]() |
| [14*]c1cc(=O)c2c(O)c(O)c(O)cc2o1 | None | 39 | ![]() |
| [16*]c1ccccc1 | None | 39 | ![]() |
| [14*]c1oc2cc(O)cc(O)c2c(=O)c1O | 4.48 | 39 | ![]() |
| [16*]c1ccc(O)c(O)c1 | 4.48 | 39 | ![]() |