Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LIPE | Q05469 | 10/20 | 0.40 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
| ▸ | DRD3 | P35462 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL12342 | 0.82 | LIPE (0.52) | LIPETRPV1DRD2KCNH2 | |
| SCHEMBL12336 | 0.81 | TRPV1 (0.33) | LIPETRPV1DRD2DRD3KCNH2 | |
| SCHEMBL10019 | 0.75 | LIPE (0.69) | LIPETRPV1 | |
| SCHEMBL10020 | 0.75 | LIPE (0.69) | LIPETRPV1 | |
| SCHEMBL5706 | 0.72 | LIPE (0.55) | LIPETRPV1 | |
| SCHEMBL5705 | 0.72 | LIPE (0.55) | LIPETRPV1 | |
| SCHEMBL12702552 | 0.72 | LIPE (0.55) | LIPETRPV1 | |
| SCHEMBL1589386 | 0.72 | LIPE (0.53) | LIPETRPV1 | |
| SCHEMBL1589384 | 0.72 | LIPE (0.53) | LIPETRPV1 | |
| SCHEMBL12702141 | 0.72 | LIPE (0.53) | LIPE |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011045292-A1 | SPIRO-CONDENSED CYCLOHEXANE DERIVATIVES AS HSL INHIBITORS USEFUL FOR THE TREATMENT OF DIABETES | F. HOFFMANN-LA ROCHE AG (CH) | 2011-04-21 | — | — | WO | disclosed |