Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.42 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | DAO | P14920 | 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 | |
|---|---|---|---|---|
| SCHEMBL16952751 | 0.85 | GABRA1 (0.61) | GABRA1GABRB2ALDH1A1DAO | |
| SCHEMBL16958191 | 0.81 | GABRA1 (0.42) | GABRA1GABRB2DAO | |
| SCHEMBL4950642 | 0.81 | ALDH1A1 (0.34) | GABRA1GABRB2ALDH1A1DAO | |
| SCHEMBL78218 | 0.80 | ALDH1A1 (0.41) | ALDH1A1 | |
| SCHEMBL16951878 | 0.79 | ALDH1A1 (0.33) | GABRA1GABRB2ALDH1A1DAO | |
| SCHEMBL9310371 | 0.79 | ALDH1A1 (0.33) | GABRA1GABRB2ALDH1A1DAO | |
| Butane SCHEMBL9310262 | 0.79 | ALDH1A1 (0.40) | ALDH1A1 | |
| SCHEMBL15524298 | 0.79 | GABRA1 (0.37) | GABRA1GABRB2ALDH1A1 | |
| SCHEMBL5039126 | 0.78 | CNR2 (0.34) | ALDH1A1DAO | |
| SCHEMBL16957146 | 0.78 | ALDH1A1 (0.41) | ALDH1A1DAO |
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 |