Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 6/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.48 |
| ▸ | CYP19A1 | P11511 | 5/20 | 0.47 |
| ▸ | CYP11B2 | P19099 | 4/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.41 |
| ▸ | QPCT | Q16769 | 1/20 | 0.41 |
| ▸ | CYP4Z1 | Q86W10 | 1/20 | 0.41 |
| ▸ | QPCTL | Q9NXS2 | 1/20 | 0.41 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.38 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL7740341 | 0.83 | CYP11B1 (0.57) | CYP11B1CYP1A2CYP2D6CYP19A1CYP11B2 | |
| SCHEMBL7740309 | 0.75 | HMOX1 (0.36) | CYP11B1CYP1A2CYP2D6CYP19A1CYP11B2 | |
| SCHEMBL1687036 | 0.71 | NAPRT (0.73) | CYP1A2CYP2D6POLBCYP3A4TBXAS1 | |
| SCHEMBL570582 | 0.69 | CYP11B1 (1.00) | CYP11B1CYP1A2CYP2D6CYP19A1CYP11B2 | |
| SCHEMBL31408151 | 0.69 | CYP11B1 (0.59) | CYP11B1CYP1A2CYP2D6CYP19A1CYP11B2 | |
| SCHEMBL2716739 | 0.69 | CYP11B1 (0.59) | CYP11B1CYP1A2CYP2D6CYP19A1CYP11B2 | |
| SCHEMBL7737870 | 0.69 | CYP19A1 (0.67) | CYP11B1CYP19A1CYP11B2POLBTBXAS1 | |
| SCHEMBL6011929 | 0.68 | RAB9A (0.57) | CYP1A2CYP2D6POLBCYP3A4NAPRT | |
| SCHEMBL2749985 | 0.67 | CYP1A2 (0.71) | CYP11B1CYP1A2CYP2D6CYP11B2TBXAS1 | |
| SCHEMBL8337928 | 0.67 | TBXAS1 (0.54) | CYP11B1CYP2D6CYP19A1CYP11B2CYP3A4 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-RE37781-E1 | VIRICIDES, PROTEASE INHIBITOR | DUPONT PHARMACEUTICALS COMPANY | 2002-07-02 | — | — | US | disclosed |