Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | STAT1 | P42224 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | MTNR1A | P48039 | 8/20 | 0.47 |
| ▸ | MTNR1B | P49286 | 8/20 | 0.47 |
| ▸ | CES2 | O00748 | 1/20 | 0.46 |
| ▸ | CES1 | P23141 | 1/20 | 0.46 |
| ▸ | ALPL | P05186 | 1/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | ALPI | P09923 | 1/20 | 0.46 |
| ▸ | ALPG | P10696 | 1/20 | 0.46 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL14519898 | 1.00 | ALDH1A1 (0.51) | ALDH1A1LMNANPC1MAPTMAPK1 | |
| SCHEMBL5743082 | 0.87 | ALDH1A1 (0.48) | ALDH1A1LMNANPC1MAPTMAPK1 | |
| SCHEMBL1900108 | 0.84 | GAA (0.57) | ALDH1A1LMNAMAPTHTT | |
| SCHEMBL29675790 | 0.83 | MTNR1A (0.50) | ALDH1A1LMNANPC1MAPTMAPK1 | |
| SCHEMBL18814665 | 0.82 | GAA (0.49) | ALDH1A1LMNAMAPTHTTALPL | |
| SCHEMBL29339261 | 0.82 | CYP1A2 (0.46) | ALDH1A1LMNANPC1MAPTMAPK1 | |
| SCHEMBL16906331 | 0.78 | HSD17B10 (0.49) | LMNAMAPTMAPK1HTTSMN1; SMN2 | |
| SCHEMBL1546686 | 0.78 | CES2 (0.50) | LMNANPC1MAPTMAPK1STAT1 | |
| SCHEMBL20720155 | 0.78 | ALDH1A1 (0.42) | ALDH1A1LMNANPC1MAPTMAPK1 | |
| SCHEMBL20720156 | 0.78 | ALDH1A1 (0.42) | ALDH1A1LMNANPC1MAPTMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-108617166-B | Protein kinase inhibitor benzolactam compounds | 大冢制药株式会社 | 2022-05-17 | — | — | CN | claimed |