Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | KCNA5 | P22460 | 4/20 | 0.37 |
| ▸ | GPR139 | Q6DWJ6 | 1/20 | 0.36 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.34 |
| ▸ | GSK3B | P49841 | 2/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 4/20 | 0.33 |
| ▸ | CNR2 | P34972 | 3/20 | 0.33 |
| ▸ | TNF | P01375 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL24527557 | 0.76 | ALDH1A1 (0.34) | ALDH1A1 | |
| SCHEMBL24527565 | 0.75 | PNMT (0.42) | — | |
| SCHEMBL25833983 | 0.73 | CNR1 (0.43) | ALDH1A1GLAKCNA5GPR139S1PR1 | |
| SCHEMBL16955156 | 0.72 | ENPP2 (0.40) | GRM4GLAKCNA5S1PR1GSK3B | |
| SCHEMBL24527617 | 0.71 | MAOB (0.50) | — | |
| SCHEMBL6163795 | 0.69 | ENPP2 (0.46) | ALDH1A1GRM4S1PR1GSK3BTNF | |
| SCHEMBL12322591 | 0.69 | AOC3 (0.41) | ALDH1A1GRM4GLAKCNA5S1PR1 | |
| SCHEMBL19715854 | 0.69 | ENPP2 (0.40) | ALDH1A1GLAKCNA5S1PR1GSK3B | |
| SCHEMBL10768015 | 0.69 | NOTUM (0.36) | ALDH1A1GLAKCNA5S1PR1DRD2 | |
| SCHEMBL5545605 | 0.68 | CNR1 (0.43) | GRM4GLAS1PR1CNR1CNR2 |
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-2022131741-A1 | ISOXAZOLIDINE DERIVATIVE COMPOUND AND USE THEREOF | 보로노이바이오 주식회사 | 2022-06-23 | — | — | WO | disclosed |