Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 1/20 | 0.48 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.48 |
| ▸ | HRH3 | Q9Y5N1 | 9/20 | 0.46 |
| ▸ | SPHK1 | Q9NYA1 | 4/20 | 0.44 |
| ▸ | SPHK2 | Q9NRA0 | 3/20 | 0.44 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.42 |
| ▸ | LTA4H | P09960 | 2/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.42 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL2822642 | 0.89 | FFAR1 (0.53) | OPRM1OPRK1HRH3SPHK1SPHK2 | |
| SCHEMBL2824720 | 0.89 | HRH3 (0.42) | HRH3SPHK1SPHK2SCN3AMAOA | |
| SCHEMBL2824092 | 0.87 | SPHK1 (0.52) | HRH3SPHK1SPHK2MAOAMAOB | |
| SCHEMBL2826434 | 0.87 | SPHK1 (0.52) | HRH3SPHK1SPHK2MAOAMAOB | |
| SCHEMBL13887158 | 0.86 | FFAR1 (0.58) | OPRM1OPRK1HRH3SPHK1SPHK2 | |
| SCHEMBL2827661 | 0.84 | HRH3 (0.42) | HRH3SPHK1SPHK2SCN3AMAOA | |
| SCHEMBL2827471 | 0.84 | HRH3 (0.44) | HRH3SPHK1SCN3AMAOAMAOB | |
| SCHEMBL2827613 | 0.83 | LTA4H (0.53) | HRH3LTA4HEPHX2NPC1RAB9A | |
| Trifluoroacetic Acid SCHEMBL2824716 | 0.79 | FFAR1 (0.49) | HRH3SPHK1FFAR1FFAR4 | |
| SCHEMBL2823889 | 0.78 | LTA4H (0.65) | HRH3LTA4HEPHX2NPC1RAB9A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1731505-B1 | ALKOXYPHENYLPROPANOIC ACID DERIVATIVES | TAKEDA PHARMACEUTICAL (JP) | 2015-01-14 | — | — | EP | disclosed |
| EP-2253315-A1 | Alkoxyphenylpropanoic acid derivatives | Takeda Pharmaceutical Company Limited (JP) | 2010-11-24 | — | — | EP | disclosed |
| EP-1731505-A1 | ALKOXYPHENYLPROPANOIC ACID DERIVATIVES | Takeda Pharmaceutical Company Limited (JP) | 2006-12-13 | — | — | EP | disclosed |