Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 2/20 | 0.37 |
| ▸ | MAOB | P27338 | 2/20 | 0.37 |
| ▸ | KDM1A | O60341 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | CHIA | Q9BZP6 | 1/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LTA4H | P09960 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL22901857 | 1.00 | MAOA (0.37) | MAOAMAOBKDM1AKCNH2CHIA | |
| SCHEMBL22903711 | 0.85 | TRPA1 (0.36) | MAOAMAOBKDM1AKCNH2CHIA | |
| SCHEMBL22901928 | 0.85 | TRPA1 (0.36) | MAOAMAOBKDM1AKCNH2CHIA | |
| SCHEMBL23459290 | 0.83 | POLB (0.46) | MEN1KMT2A | |
| SCHEMBL18589425 | 0.78 | TRPA1 (0.41) | KCNH2TRPA1PPARGALDH1A1 | |
| SCHEMBL18609377 | 0.78 | TRPA1 (0.41) | KCNH2TRPA1PPARGALDH1A1 | |
| Trifluoroacetic Acid SCHEMBL18577478 | 0.71 | TRPA1 (0.42) | KDM1ATRPA1ALDH1A1 | |
| SCHEMBL21565752 | 0.71 | POLB (0.47) | ALDH1A1LTA4H | |
| SCHEMBL25384689 | 0.70 | OPRM1 (0.39) | KCNH2CHIA | |
| SCHEMBL25384636 | 0.70 | LTA4H (0.36) | TRPA1ALDH1A1LTA4H |
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-2021009209-A1 | SUBSTITUTED AMINO TRIAZOLES USEFUL AS CHITINASE INHIBITORS | Oncoarendi Therapeutics S.A. (PL) | 2021-01-21 | — | — | WO | disclosed |