Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3149427 | 0.69 | CA12 (0.32) | — | |
| SCHEMBL457537 | 0.68 | GAA (0.36) | ALDH1A1PTGS1PTGS2 | |
| SCHEMBL3157514 | 0.68 | HSD11B1 (0.31) | ALDH1A1 | |
| SCHEMBL3161088 | 0.68 | CA1 (0.30) | — | |
| SCHEMBL5283885 | 0.67 | HSD11B1 (0.31) | — | |
| SCHEMBL5302036 | 0.67 | EGFR (0.31) | — | |
| SCHEMBL3154121 | 0.67 | IL2 (0.33) | — | |
| SCHEMBL3150353 | 0.66 | CA1 (0.31) | — | |
| SCHEMBL20871127 | 0.65 | PTGS1 (0.35) | PTGS1PTGS2 | |
| SCHEMBL20861670 | 0.65 | PTGS1 (0.35) | PTGS1PTGS2 |
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-2011033251-A1 | HERBICIDAL ISOXAZOLINE DERIVATIVES | SYNGENTA LIMITED (GB) | 2011-03-24 | — | — | WO | disclosed |