Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | PAOX | Q6QHF9 | 1/20 | 0.39 |
| ▸ | GBA1 | P04062 | 1/20 | 0.38 |
| ▸ | FPR3 | P25089 | 1/20 | 0.37 |
| ▸ | FPR2 | P25090 | 1/20 | 0.37 |
| ▸ | CHKA | P35790 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | LSS | P48449 | 1/20 | 0.36 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL17806049 | 0.96 | CHKA (0.41) | HRH3PAOXGBA1FPR3FPR2 | |
| SCHEMBL438183 | 0.92 | PAOX (0.44) | MAPTPAOXGBA1SIGMAR1TP53 | |
| SCHEMBL439509 | 0.89 | HRH3 (0.52) | HRH3MAPTGBA1FPR3FPR2 | |
| SCHEMBL439729 | 0.87 | HRH3 (0.56) | HRH3MAPTGBA1MEN1KMT2A | |
| SCHEMBL172955 | 0.87 | HRH3 (0.56) | HRH3MAPTGBA1MEN1KMT2A | |
| SCHEMBL105381 | 0.85 | PAOX (0.47) | HRH3PAOXGBA1SIGMAR1TP53 | |
| SCHEMBL441042 | 0.85 | HRH3 (0.46) | HRH3MAPTGBA1FPR3FPR2 | |
| SCHEMBL25565620 | 0.85 | GBA1 (0.46) | HRH3GBA1SIGMAR1TP53SMN1; SMN2 | |
| SCHEMBL24752794 | 0.83 | PAOX (0.50) | HRH3PAOXSIGMAR1TP53SMN1; SMN2 | |
| SCHEMBL8116181 | 0.83 | PAOX (0.50) | HRH3PAOXSIGMAR1TP53SMN1; SMN2 |
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-2019046711-A2 | COMPOUNDS AND COMPOSITIONS FOR IRE1 INHIBITION | OPTIKIRA LLC (US) | 2019-03-07 | — | — | WO | disclosed |