Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 1/20 | 0.33 |
| ▸ | GSK3B | P49841 | 1/20 | 0.32 |
| ▸ | TPMT | P51580 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.31 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.31 |
| ▸ | C1S | P09871 | 1/20 | 0.31 |
| ▸ | PRSS3 | P35030 | 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 | |
|---|---|---|---|---|
| SCHEMBL16960711 | 0.85 | ALDH1A1 (0.33) | KDRTPMTALDH1A1MAPK1PRSS1 | |
| SCHEMBL16950603 | 0.83 | KDR (0.33) | KDRTPMTALDH1A1MAPK1PRSS1 | |
| SCHEMBL16956366 | 0.82 | KDR (0.32) | KDRTPMTALDH1A1MAPK1PRSS1 | |
| SCHEMBL16950735 | 0.82 | KDR (0.35) | KDRTPMTALDH1A1MAPK1PRSS1 | |
| SCHEMBL16960686 | 0.82 | ALDH1A1 (0.37) | KDRGSK3BTPMTALDH1A1MAPK1 | |
| SCHEMBL16951853 | 0.79 | HPGD (0.32) | KDRALDH1A1 | |
| SCHEMBL16953365 | 0.79 | ALDH1A1 (0.38) | KDRALDH1A1 | |
| SCHEMBL7787277 | 0.78 | GSK3B (0.53) | KDRGSK3BTPMTALDH1A1 | |
| SCHEMBL16958487 | 0.77 | KDR (0.33) | KDRALDH1A1 | |
| SCHEMBL16959215 | 0.77 | TPMT (0.38) | KDRTPMTALDH1A1MAPK1PRSS1 |
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 |