Target ID: CHEMBL3977
Organism: Homo sapiens
Type: SINGLE PROTEIN
Name | SMILES | Bioactivity | Structure |
---|---|---|---|
ROLIPRAM | COc1ccc(C2CNC(=O)C2)cc1OC1CCCC1 | IC50: 1000.0 nM | ![]() |
SILDENAFIL CITRATE | CCCc1nn(C)c2c(=O)[nH]c(-c3cc(S(=O)(=O)N4CCN(C)CC4)ccc3OCC)nc12.O=C(O)CC(O)(CC(=O)O)C(=O)O | IC50: 2.2 nM | ![]() |
SILDENAFIL | CCCc1nn(C)c2c(=O)[nH]c(-c3cc(S(=O)(=O)N4CCN(C)CC4)ccc3OCC)nc12 | Pc: 87000000.0 cm s-1 | ![]() |
TADALAFIL | CN1CC(=O)N2[C@H](c3ccc4c(c3)OCO4)c3[nH]c4ccccc4c3C[C@@H]2C1=O | IC50: 6.7 nM | ![]() |
SMILES | Avg pKi | Count | Structure |
---|---|---|---|
[3*]O[3*] | 7.33 | 117 | ![]() |
[14*]c1nc2c([14*])nn(C)c2c(=O)[nH]1 | 8.66 | 78 | ![]() |
[12*]S(=O)(=O)c1ccc([16*])c([16*])c1 | 8.66 | 78 | ![]() |
[8*]CCC | 8.66 | 78 | ![]() |
[5*]N1CCN(C)CC1 | 8.66 | 78 | ![]() |