Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.30 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | CA9 | Q16790 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8336641 | 1.00 | CYP3A4 (0.33) | CYP3A4CYP2D6CYP2C9TRPV1CNR2 | |
| SCHEMBL8338232 | 1.00 | CYP3A4 (0.33) | CYP3A4CYP2D6CYP2C9TRPV1CNR2 | |
| SCHEMBL8340205 | 0.99 | CYP3A4 (0.34) | CYP3A4CYP2D6CYP2C9TRPV1CNR2 | |
| SCHEMBL8340421 | 0.96 | CYP3A4 (0.34) | CYP3A4CYP2D6CYP2C9TRPV1 | |
| SCHEMBL8340290 | 0.92 | POLB (0.32) | CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8338458 | 0.87 | GAA (0.37) | — | |
| SCHEMBL8339075 | 0.87 | GAA (0.37) | — | |
| SCHEMBL8389229 | 0.87 | GAA (0.37) | — | |
| SCHEMBL8333109 | 0.87 | GAA (0.37) | — | |
| SCHEMBL8339670 | 0.87 | MEN1 (0.31) | CYP3A4CYP2D6CYP2C9 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5977177-A | Substituted benzenesulfonylureas and-thioureas, processes for their preparation and use of pharmaceutical preparations based on these compounds, and medicaments containing them | HOECHST AKTIENGESELLSCHAFT (DE) | 1999-11-02 | — | — | US | disclosed |
| US-5880155-A | TREATMENT OF CARDIOVASCULAR DISORDERS | HOECHST AKTIENGESELLSCHAFT (DE) | 1999-03-09 | — | — | US | disclosed |