Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBXAS1 | P24557 | 4/20 | 0.36 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.31 |
| ▸ | TBXA2R | P21731 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9245337 | 1.00 | TBXAS1 (0.36) | TBXAS1CYP2B6TBXA2R | |
| SCHEMBL9248629 | 1.00 | TBXAS1 (0.36) | TBXAS1CYP2B6TBXA2R | |
| SCHEMBL9245351 | 1.00 | TBXAS1 (0.36) | TBXAS1CYP2B6TBXA2R | |
| SCHEMBL8714592 | 0.81 | TBXAS1 (0.40) | TBXAS1CYP2B6TBXA2R | |
| SCHEMBL9250010 | 0.79 | TBXAS1 (0.39) | TBXAS1CYP2B6TBXA2R | |
| SCHEMBL9248132 | 0.79 | SPHK2 (0.34) | — | |
| SCHEMBL8714481 | 0.79 | SPHK2 (0.34) | — | |
| SCHEMBL9243807 | 0.79 | SPHK2 (0.34) | — | |
| SCHEMBL9243819 | 0.79 | SPHK2 (0.34) | — | |
| SCHEMBL9243810 | 0.79 | SPHK2 (0.34) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0524439-A1 | Novel cyclohexane and tetrahydropyran derivatives and antifungal compositions containing these derivatives | F.HOFFMANN-LA ROCHE & CO. AKTIENGESELLSCHAFT (CH) | 1993-01-27 | — | — | EP | claimed |
| US-5449785-A | Fungicides with triazole groups | HOFFMANN-LA ROCHE INC. (US) | 1995-09-12 | — | — | US | disclosed |
| EP-0524439-A1 | Novel cyclohexane and tetrahydropyran derivatives and antifungal compositions containing these derivatives | F.HOFFMANN-LA ROCHE & CO. AKTIENGESELLSCHAFT (CH) | 1993-01-27 | — | — | EP | disclosed |