Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.71 |
| ▸ | GAA | P10253 | 2/20 | 0.71 |
| ▸ | MAPT | P10636 | 1/20 | 0.71 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 3/20 | 0.51 |
| ▸ | CA1 | P00915 | 4/20 | 0.51 |
| ▸ | CA2 | P00918 | 4/20 | 0.51 |
| ▸ | CA5A | P35218 | 2/20 | 0.51 |
| ▸ | CA7 | P43166 | 2/20 | 0.51 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.51 |
| ▸ | NPY5R | Q15761 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.49 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | CA12 | O43570 | 3/20 | 0.49 |
| ▸ | CA9 | Q16790 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL18868428 | 0.90 | ALDH1A1 (0.61) | ALDH1A1GAAMAPTHDAC1LMNA | |
| SCHEMBL28571160 | 0.84 | ALDH1A1 (0.60) | ALDH1A1GAAMAPTLMNAL3MBTL1 | |
| SCHEMBL20379348 | 0.84 | ALDH1A1 (0.71) | ALDH1A1GAAMAPTHDAC1LMNA | |
| SCHEMBL11613978 | 0.83 | ALDH1A1 (1.00) | ALDH1A1GAAMAPTHDAC1LMNA | |
| SCHEMBL6962953 | 0.83 | ALDH1A1 (0.73) | ALDH1A1GAAMAPTHDAC1LMNA | |
| SCHEMBL21485020 | 0.82 | ALDH1A1 (0.73) | ALDH1A1GAALMNACA1CA2 | |
| SCHEMBL5175288 | 0.80 | ALDH1A1 (0.66) | ALDH1A1GAAMAPTNPY5RRAB9A | |
| SCHEMBL21690117 | 0.80 | ALDH1A1 (0.65) | ALDH1A1GAAMAPTHDAC1LMNA | |
| SCHEMBL8269187 | 0.79 | HDAC3 (0.52) | ALDH1A1MAPTHDAC1LMNACA1 | |
| SCHEMBL22664776 | 0.79 | ALDH1A1 (0.82) | ALDH1A1GAAMAPTHDAC1LMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114846013-B | Novel aminoaryl derivatives useful as diacylglycerol acyltransferase 2 inhibitors and uses thereof | 株式会社LG化学 | 2024-12-20 | — | — | CN | disclosed |
| CN-114846013-A | Novel aminoaryl derivatives useful as diacylglycerol acyltransferase 2 inhibitors and uses thereof | 株式会社LG化学 | 2022-08-02 | — | — | CN | disclosed |