Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBXAS1 | P24557 | 1/20 | 0.39 |
| ▸ | TBXA2R | P21731 | 3/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.34 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8714592 | 0.83 | TBXAS1 (0.40) | TBXAS1TBXA2RCYP19A1CYP2B6SMN1; SMN2 | |
| SCHEMBL9249303 | 0.81 | — | — | |
| SCHEMBL9248629 | 0.79 | TBXAS1 (0.36) | TBXAS1TBXA2RCYP2B6 | |
| SCHEMBL9245337 | 0.79 | TBXAS1 (0.36) | TBXAS1TBXA2RCYP2B6 | |
| SCHEMBL9245351 | 0.79 | TBXAS1 (0.36) | TBXAS1TBXA2RCYP2B6 | |
| SCHEMBL9250188 | 0.78 | TBXAS1 (0.42) | TBXAS1TBXA2RCYP19A1CYP2B6SMN1; SMN2 | |
| SCHEMBL9250184 | 0.78 | TBXAS1 (0.42) | TBXAS1TBXA2RCYP19A1CYP2B6SMN1; SMN2 | |
| SCHEMBL9244403 | 0.77 | POLB (0.45) | TBXAS1CYP19A1 | |
| SCHEMBL9244400 | 0.77 | CYP19A1 (0.45) | TBXAS1CYP19A1CYP2D6 | |
| SCHEMBL8714968 | 0.76 | GBA1 (0.37) | HTT |
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 |