Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 10/20 | 0.49 |
| ▸ | CYP11B2 | P19099 | 8/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.40 |
| ▸ | QPCT | Q16769 | 1/20 | 0.40 |
| ▸ | CYP4Z1 | Q86W10 | 1/20 | 0.40 |
| ▸ | QPCTL | Q9NXS2 | 1/20 | 0.40 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7740273 | 0.89 | CYP2D6 (0.40) | CYP11B1CYP11B2CYP2D6CYP1A2CYP3A4 | |
| SCHEMBL7740339 | 0.75 | CYP11B1 (0.46) | CYP11B1CYP11B2CYP19A1CYP2D6CYP1A2 | |
| SCHEMBL27956577 | 0.71 | AGER (0.42) | CYP11B1CYP11B2CYP19A1CYP2D6CYP1A2 | |
| SCHEMBL7073814 | 0.69 | CYP1A2 (0.49) | CYP11B1CYP11B2CYP2D6CYP1A2CYP2A6 | |
| SCHEMBL7452986 | 0.69 | CYP2D6 (0.49) | CYP11B1CYP11B2CYP2D6CYP1A2CYP3A4 | |
| SCHEMBL570582 | 0.68 | CYP11B1 (1.00) | CYP11B1CYP11B2CYP19A1CYP2D6CYP1A2 | |
| SCHEMBL7737867 | 0.66 | CYP19A1 (0.56) | CYP11B1CYP11B2CYP19A1CYP2D6POLB | |
| SCHEMBL6306258 | 0.65 | CYP19A1 (0.54) | CYP19A1POLB | |
| SCHEMBL7740291 | 0.64 | CYP11B1 (0.51) | CYP11B1CYP11B2CYP19A1CYP2D6CYP1A2 | |
| SCHEMBL11012977 | 0.63 | CYP11B1 (0.66) | CYP11B1CYP19A1CYP2D6CYP3A4TBXAS1 |
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 |