Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | EPHX1 | P07099 | 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 | |
|---|---|---|---|---|
| SCHEMBL12910028 | 0.76 | DPP4 (0.36) | ALDH1A1L3MBTL1EPHX1 | |
| SCHEMBL21216559 | 0.76 | PDK2 (0.31) | — | |
| SCHEMBL20204150 | 0.72 | GAA (0.42) | ALDH1A1EPHX1 | |
| SCHEMBL24782283 | 0.72 | PDK2 (0.34) | — | |
| SCHEMBL21216595 | 0.71 | PDK2 (0.44) | — | |
| SCHEMBL21311704 | 0.70 | GAA (0.34) | ALDH1A1L3MBTL1EPHX1 | |
| SCHEMBL9235459 | 0.69 | PDK1 (0.36) | EPHX1 | |
| SCHEMBL5387956 | 0.69 | EPHX1 (0.35) | EPHX1 | |
| SCHEMBL5387959 | 0.69 | EPHX1 (0.35) | EPHX1 | |
| SCHEMBL13564592 | 0.68 | EPHX1 (0.33) | ALDH1A1L3MBTL1EPHX1 |
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-2019162391-A1 | METHOD FOR PRODUCING FLUORINATED HETEROCYCLIC ALIPHATIC COMPOUNDS | Westfälische Wilhelms-Universität Münster (DE) | 2019-08-29 | — | — | WO | disclosed |