Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL24540153 | 0.86 | ALDH1A1 (0.46) | ALDH1A1KMT2ARAB9AGAALMNA | |
| SCHEMBL31384524 | 0.86 | ALDH1A1 (0.51) | ALDH1A1KMT2ARAB9AGAALMNA | |
| SCHEMBL13533438 | 0.83 | ALDH1A1 (0.49) | ALDH1A1KMT2ARAB9ALMNASMN1; SMN2 | |
| SCHEMBL858791 | 0.83 | ALDH1A1 (0.49) | ALDH1A1KMT2ARAB9ALMNASMN1; SMN2 | |
| SCHEMBL8058467 | 0.83 | ALDH1A1 (0.49) | ALDH1A1KMT2ARAB9AGAALMNA | |
| SCHEMBL858792 | 0.83 | ALDH1A1 (0.49) | ALDH1A1KMT2ARAB9ALMNASMN1; SMN2 | |
| SCHEMBL31384566 | 0.83 | ALDH1A1 (0.43) | ALDH1A1KMT2AGAAMAPTCYP3A4 | |
| SCHEMBL8357538 | 0.82 | ALDH1A1 (0.47) | ALDH1A1KMT2ARAB9AGAALMNA | |
| SCHEMBL31384511 | 0.82 | ALDH1A1 (0.47) | ALDH1A1L3MBTL1MAPK1CYP3A4TSHR | |
| SCHEMBL31384506 | 0.81 | TSHR (0.43) | ALDH1A1KMT2AMAPTCYP3A4TSHR |
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-2025002357-A1 | TETRODOTOXIN DERIVATIVE COMPOUND AND USE THEREOF AS SODIUM CHANNEL BLOCKER | 博璞诺（上海）医药科技发展有限公司 | 2025-01-02 | — | — | WO | disclosed |