Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | MMP1 | P03956 | 3/20 | 0.37 |
| ▸ | MMP2 | P08253 | 3/20 | 0.37 |
| ▸ | MMP9 | P14780 | 3/20 | 0.37 |
| ▸ | MMP13 | P45452 | 3/20 | 0.37 |
| ▸ | MMP3 | P08254 | 2/20 | 0.37 |
| ▸ | MMP7 | P09237 | 2/20 | 0.37 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.37 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.37 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.37 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.37 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.37 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL778325 | 0.79 | HTT (0.40) | ALDH1A1AOC3HTTMMP1MMP2 | |
| SCHEMBL4357847 | 0.79 | ALDH1A1 (0.64) | ALDH1A1LMNASMN1; SMN2KDM4E | |
| SCHEMBL13025222 | 0.72 | HDAC3 (0.41) | ALDH1A1AOC3MMP1MMP2MMP9 | |
| SCHEMBL3892075 | 0.71 | HTT (0.37) | ALDH1A1HTTMMP1MMP2MMP9 | |
| SCHEMBL3136274 | 0.71 | MME (0.38) | ALDH1A1AOC3HTTMMP1MMP2 | |
| SCHEMBL6865523 | 0.71 | HTT (0.37) | ALDH1A1AOC3HTTMMP1MMP2 | |
| SCHEMBL30546653 | 0.71 | EPHX2 (0.45) | ALDH1A1HTTLMNAKDM4E | |
| SCHEMBL3884840 | 0.70 | CA1 (0.40) | ALDH1A1HTTMMP1MMP2MMP9 | |
| SCHEMBL11857244 | 0.69 | CA1 (0.45) | ALDH1A1HTTMMP1MMP2MMP9 | |
| SCHEMBL8604367 | 0.69 | ALOX5 (0.44) | ALDH1A1HTTSMN1; SMN2KDM4EDAO |
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-108699059-B | Tricyclic compounds useful for treating orthomyxovirus infections | 诺华股份有限公司 | 2021-06-18 | — | — | CN | disclosed |