Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FAAH | O00519 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.32 |
| ▸ | SPHK2 | Q9NRA0 | 1/20 | 0.31 |
| ▸ | SPHK1 | Q9NYA1 | 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 | |
|---|---|---|---|---|
| SCHEMBL9247176 | 1.00 | FAAH (0.33) | FAAHMEN1TP53CYP1A2CYP3A4 | |
| SCHEMBL9247184 | 1.00 | FAAH (0.33) | FAAHMEN1TP53CYP1A2CYP3A4 | |
| SCHEMBL8715892 | 0.88 | FAAH (0.33) | FAAHMEN1TP53CYP1A2CYP3A4 | |
| SCHEMBL9249244 | 0.80 | GBA1 (0.35) | CYP1A2CYP2C19ALOX5 | |
| SCHEMBL9249237 | 0.80 | GBA1 (0.35) | CYP1A2CYP2C19ALOX5 | |
| SCHEMBL9249234 | 0.80 | GBA1 (0.35) | CYP1A2CYP2C19ALOX5 | |
| SCHEMBL9249039 | 0.75 | SPHK1 (0.30) | SPHK1 | |
| SCHEMBL9567689 | 0.75 | TRPV1 (0.43) | FAAHMEN1TP53CYP1A2CYP3A4 | |
| SCHEMBL9567681 | 0.75 | TRPV1 (0.43) | FAAHMEN1TP53CYP1A2CYP3A4 | |
| SCHEMBL9567686 | 0.75 | TRPV1 (0.43) | FAAHMEN1TP53CYP1A2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-5719291-A | FUNGICIDE | HOFFMANN-LA ROCHE INC. (US) | 1998-02-17 | — | — | US | disclosed |
| 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 |