Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR3 | O14843 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | FAAH | O00519 | 8/20 | 0.31 |
| ▸ | NOS1 | P29475 | 1/20 | 0.31 |
| ▸ | NOS2 | P35228 | 1/20 | 0.31 |
| ▸ | CES1 | P23141 | 5/20 | 0.30 |
| ▸ | CES2 | O00748 | 2/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL29603858 | 0.78 | ALDH1A1 (0.59) | FFAR3ALDH1A1TDP1FAAHCES1 | |
| SCHEMBL1933565 | 0.77 | — | — | |
| SCHEMBL9969955 | 0.77 | — | — | |
| SCHEMBL12299282 | 0.77 | — | — | |
| Trifluoroacetic Acid SCHEMBL20527475 | 0.75 | FFAR3 (0.62) | FFAR3ALDH1A1TDP1FAAHCES1 | |
| Trifluoroacetic Acid SCHEMBL4485807 | 0.75 | FFAR3 (0.62) | FFAR3ALDH1A1TDP1FAAHCES1 | |
| Trifluoroacetic Acid SCHEMBL27841664 | 0.74 | FAAH (0.42) | FFAR3ALDH1A1FAAHCES1CES2 | |
| Trifluoroacetic Acid SCHEMBL31031817 | 0.74 | FAAH (0.42) | FFAR3ALDH1A1FAAHCES1CES2 | |
| Trifluoroacetic Acid SCHEMBL27632684 | 0.72 | TDP1 (0.59) | FFAR3ALDH1A1TDP1FAAHCES1 | |
| Trifluoroacetic Acid SCHEMBL27943966 | 0.72 | FFAR3 (0.42) | FFAR3ALDH1A1TDP1FAAHCES1 |
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-2012026608-A1 | POLYMERIC PARTICLE AND HYDROPHILIC DYE HAVING A SULFONATE GROUP ENCAPSULATED WITHIN THE PARTICLE | CANON KABUSHIKI KAISHA (JP) | 2012-03-01 | — | — | WO | disclosed |