Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.37 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.34 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5886575 | 0.89 | ADORA3 (0.43) | ALOX5ADORA3ADORA2AADORA2BADORA1 | |
| SCHEMBL5886617 | 0.85 | KCNH2 (0.50) | ADORA3ADORA2AADORA2BADORA1KCNH2 | |
| SCHEMBL9906388 | 0.83 | — | — | |
| SCHEMBL6643512 | 0.80 | ALOX5 (0.37) | ALOX5ALDH1A1CYP3A4ALOX15 | |
| SCHEMBL16345143 | 0.75 | — | — | |
| SCHEMBL16345466 | 0.75 | — | — | |
| SCHEMBL7571198 | 0.75 | — | — | |
| SCHEMBL1799185 | 0.75 | ALOX5 (0.43) | ALOX5TP53NPC1RAB9AALDH1A1 | |
| SCHEMBL9906039 | 0.74 | ALOX5 (0.43) | ALOX5TP53ALDH1A1 | |
| Potassium SCHEMBL2593640 | 0.73 | KCNH2 (0.42) | ALOX5ADORA3ADORA2AADORA2BADORA1 |
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-2009137345-A1 | THERAPEUTIC COMPOUNDS | ALLERGAN, INC. (US) | 2009-11-12 | — | — | WO | disclosed |