Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 6/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.39 |
| ▸ | PGK1 | P00558 | 1/20 | 0.33 |
| ▸ | PGK2 | P07205 | 1/20 | 0.33 |
| ▸ | IDH1 | O75874 | 1/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.31 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.30 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.30 |
| ▸ | RAPGEF4 | Q8WZA2 | 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 | |
|---|---|---|---|---|
| SCHEMBL16955867 | 0.86 | RXRA (0.36) | PTGS2PTGS1ALOX5TRPA1 | |
| SCHEMBL16956255 | 0.83 | FFAR4 (0.36) | PTGS2PGK1PGK2TRPA1 | |
| SCHEMBL16957916 | 0.80 | NPC1 (0.48) | PTGS2 | |
| SCHEMBL10823005 | 0.80 | PTGS2 (0.36) | PTGS2PTGS1ALOX5PGK1PGK2 | |
| SCHEMBL29958234 | 0.78 | CYP2A6 (0.39) | PTGS2PTGS1ALOX5PGK1PGK2 | |
| SCHEMBL395723 | 0.78 | TP53 (0.43) | PTGS2PTGS1ALOX5TUBB1RAPGEF4 | |
| SCHEMBL14017919 | 0.78 | CYP2A6 (0.39) | PTGS2PTGS1ALOX5PGK1PGK2 | |
| SCHEMBL6631552 | 0.78 | ALDH1A1 (0.45) | PTGS2PTGS1ALOX5IDH1 | |
| SCHEMBL16956048 | 0.78 | GABRA1 (0.35) | PTGS2PTGS1ALOX5PGK1PGK2 | |
| SCHEMBL16957076 | 0.77 | CNR1 (0.35) | PTGS2PTGS1ALOX5TRPA1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2900645-A1 | 3-PHENYLISOXAZOLIN DERIVATIVES WITH HERBICIDAL ACTION | Bayer CropScience AG (DE) | 2015-08-05 | — | — | EP | disclosed |