Target ID: CHEMBL2111411
Organism: Homo sapiens
Type: PROTEIN FAMILY
Name | SMILES | Bioactivity | Structure |
---|---|---|---|
TADALAFIL | CN1CC(=O)N2[C@H](c3ccc4c(c3)OCO4)c3[nH]c4ccccc4c3C[C@@H]2C1=O | IC50: 6.7 nM | ![]() |
SILDENAFIL | CCCc1nn(C)c2c(=O)[nH]c(-c3cc(S(=O)(=O)N4CCN(C)CC4)ccc3OCC)nc12 | Pc: 87000000.0 cm s-1 | ![]() |
DIPYRIDAMOLE | OCCN(CCO)c1nc(N2CCCCC2)c2nc(N(CCO)CCO)nc(N3CCCCC3)c2n1 | IC50: 500.0 nM | ![]() |
VARDENAFIL | CCCc1nc(C)c2c(=O)nc(-c3cc(S(=O)(=O)N4CCN(CC)CC4)ccc3OCC)[nH]n12 | IC50: 0.7 nM | ![]() |
SMILES | Avg pKi | Count | Structure |
---|---|---|---|
[12*]S(=O)(=O)c1ccc([16*])c([16*])c1 | 9.15 | 78 | ![]() |
[8*]CCC | 9.15 | 78 | ![]() |
[4*]CC | 9.15 | 78 | ![]() |
[3*]O[3*] | 9.15 | 78 | ![]() |
O=C1NCC(=O)N2[C@H](c3ccc4c(c3)OCO4)c3[nH]c4ccccc4c3C[C@H]12 | 8.17 | 39 | ![]() |