Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 7/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 7/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 6/20 | 0.32 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.32 |
| ▸ | GRM2 | Q14416 | 3/20 | 0.31 |
| ▸ | FPR2 | P25090 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5815956 | 1.00 | EPHX1 (0.37) | EPHX1ALDH1A1PPARGCYP1A2SLC6A2 | |
| SCHEMBL8947173 | 0.93 | FPR2 (0.35) | EPHX1ALDH1A1FPR2 | |
| SCHEMBL8947321 | 0.92 | FPR2 (0.35) | EPHX1ALDH1A1PPARGCYP1A2FPR2 | |
| SCHEMBL10015812 | 0.91 | ALOX5 (0.33) | ALDH1A1SLC6A2SLC6A4SLC6A3ALOX5 | |
| SCHEMBL9927502 | 0.91 | EPHX1 (0.34) | EPHX1ALDH1A1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL9900563 | 0.91 | EPHX1 (0.34) | EPHX1ALDH1A1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL5820344 | 0.90 | EPHX1 (0.33) | EPHX1ALDH1A1PPARG | |
| SCHEMBL22277602 | 0.90 | GAA (0.31) | — | |
| SCHEMBL15339959 | 0.89 | EPHX1 (0.33) | EPHX1ALDH1A1FPR2 | |
| SCHEMBL8947302 | 0.87 | FPR2 (0.34) | EPHX1ALDH1A1FPR2 |
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-2006125550-A1 | METHOD FOR PRODUCING TETRAHYDROPYRANES FROM TETRAHYDROPYRAN-3-ONES | MERCK PATENT GMBH (DE) | 2006-11-30 | — | — | WO | disclosed |