Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | MAPK8 | P45983 | 4/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL29209329 | 1.00 | RAB9A (0.57) | RAB9AALDH1A1TDP1GAAMAPK8 | |
| SCHEMBL1797073 | 0.86 | TDP1 (0.56) | RAB9AALDH1A1TDP1GAAMAPK8 | |
| SCHEMBL2924686 | 0.86 | RAB9A (0.76) | RAB9AALDH1A1TDP1GAAMAPK8 | |
| SCHEMBL1086604 | 0.86 | ALDH1A1 (0.70) | RAB9AALDH1A1TDP1GAAMAPK8 | |
| SCHEMBL29719568 | 0.85 | KMT2A (0.60) | RAB9AALDH1A1TDP1GAAKMT2A | |
| SCHEMBL29125555 | 0.85 | KMT2A (0.60) | RAB9AALDH1A1TDP1GAAKMT2A | |
| SCHEMBL5213935 | 0.85 | GAA (0.62) | RAB9AALDH1A1TDP1GAAMAPK8 | |
| SCHEMBL11814208 | 0.82 | RAB9A (0.55) | RAB9AALDH1A1TDP1GAAMAPK8 | |
| SCHEMBL15912476 | 0.79 | TDP1 (0.57) | RAB9AALDH1A1TDP1GAAPOLB | |
| SCHEMBL5218853 | 0.79 | ALDH1A1 (0.54) | RAB9AALDH1A1TDP1GAAMAPK8 |
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-117510338-A | Natural naphthoquinone derivative and preparation method and application thereof | 贵州大学 | 2024-02-06 | — | — | CN | disclosed |