Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.47 |
| ▸ | EPHX2 | P34913 | 5/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | PLA2G4B | P0C869 | 2/20 | 0.37 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.37 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL25856021 | 0.96 | CES2 (0.48) | CES2EPHX2CYP2C19ALDH1A1TSHR | |
| SCHEMBL20548069 | 0.95 | CES2 (0.52) | CES2EPHX2CYP2C19ALDH1A1TSHR | |
| SCHEMBL30523306 | 0.93 | ALDH1A1 (0.45) | CES2EPHX2CYP2C19ALDH1A1TSHR | |
| SCHEMBL29525974 | 0.91 | ALDH1A1 (0.50) | CES2EPHX2CYP2C19ALDH1A1TSHR | |
| SCHEMBL22609510 | 0.91 | ALDH1A1 (0.50) | CES2EPHX2CYP2C19ALDH1A1TSHR | |
| SCHEMBL1056083 | 0.91 | ALDH1A1 (0.50) | CES2EPHX2CYP2C19ALDH1A1TSHR | |
| SCHEMBL6275021 | 0.91 | ALDH1A1 (0.50) | CES2EPHX2CYP2C19ALDH1A1TSHR | |
| SCHEMBL2865428 | 0.91 | ALDH1A1 (0.50) | CES2EPHX2CYP2C19ALDH1A1TSHR | |
| SCHEMBL1172675 | 0.88 | ALDH1A1 (0.52) | CES2EPHX2CYP2C19ALDH1A1TSHR | |
| SCHEMBL23405410 | 0.88 | CES2 (0.44) | CES2EPHX2CYP2C19ALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-3609889-B1 | SMALL MOLECULES | UNIV DUNDEE (GB) | 2023-07-05 | — | — | EP | disclosed |