Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.30 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.30 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL1725786 | 0.75 | ALDH1A1 (0.47) | EPHX1MAPK1 | |
| Hydrochloric Acid SCHEMBL933591 | 0.74 | — | — | |
| SCHEMBL18533009 | 0.73 | ALDH1A1 (0.55) | EPHX1MAPK1 | |
| SCHEMBL999821 | 0.72 | ALDH1A1 (0.53) | EPHX1MAPK1 | |
| SCHEMBL999820 | 0.72 | ALDH1A1 (0.53) | EPHX1MAPK1 | |
| SCHEMBL23922520 | 0.71 | EPHX1 (0.43) | EPHX1MAPK1 | |
| SCHEMBL24503675 | 0.71 | EPHX1 (0.43) | EPHX1MAPK1 | |
| SCHEMBL22996810 | 0.71 | EPHX1 (0.43) | EPHX1MAPK1 | |
| SCHEMBL6585508 | 0.71 | — | — | |
| SCHEMBL8257944 | 0.70 | EPHX1 (0.37) | EPHX1 |
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-2018048969-A1 | MULTI-TARGETED HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 2018-03-15 | — | — | WO | disclosed |