Phosphodiesterase 7A
Target ID: CHEMBL3012
Organism: Homo sapiens
Type: SINGLE PROTEIN
Molecules
| Name | SMILES | Bioactivity | Structure |
|---|---|---|---|
| THEOPHYLLINE | Cn1c(=O)c2[nH]cnc2n(C)c1=O | ED50: 18.5 mg.kg-1 |  |
| SILDENAFIL | CCCc1nn(C)c2c(=O)[nH]c(-c3cc(S(=O)(=O)N4CCN(C)CC4)ccc3OCC)nc12 | Pc: 87000000.0 cm s-1 |  |
| ROLIPRAM | COc1ccc(C2CNC(=O)C2)cc1OC1CCCC1 | IC50: 1000.0 nM |  |
Top Fragments
| SMILES | Avg pKi | Count | Structure |
|---|---|---|---|
| [3*]O[3*] | 6.0 | 78 |  |
| O=c1[nH]c(=O)c2[nH]cnc2[nH]1 | None | 39 |  |
| Cn1c(=O)c2[nH]cnc2n(C)c1=O | None | 39 |  |
| [12*]S(=O)(=O)c1ccc([16*])c([16*])c1 | None | 39 |  |
| O=c1[nH]c(-c2cccc(S(=O)(=O)N3CCNCC3)c2)nc2cn[nH]c12 | None | 39 |  |