Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KHK | P50053 | 1/20 | 0.40 |
| ▸ | BCAT2 | O15382 | 8/20 | 0.35 |
| ▸ | BCAT1 | P54687 | 8/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.32 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | KDM1A | O60341 | 1/20 | 0.30 |
| ▸ | JAK2 | O60674 | 1/20 | 0.30 |
| ▸ | JAK3 | P52333 | 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 | |
|---|---|---|---|---|
| SCHEMBL7595081 | 0.84 | GAA (0.32) | BCAT2BCAT1GAA | |
| SCHEMBL7601120 | 0.83 | COMT (0.31) | — | |
| SCHEMBL7597082 | 0.80 | GRM4 (0.31) | GAA | |
| SCHEMBL29435262 | 0.80 | GAA (0.32) | BCAT2BCAT1GAA | |
| SCHEMBL19641780 | 0.80 | GAA (0.32) | BCAT2BCAT1GAA | |
| SCHEMBL7951139 | 0.79 | BCAT2 (0.40) | BCAT2BCAT1GAAALDH1A1 | |
| SCHEMBL7595408 | 0.79 | GAA (0.31) | GAA | |
| SCHEMBL19641854 | 0.78 | — | — | |
| SCHEMBL7602005 | 0.78 | P2RX7 (0.30) | — | |
| SCHEMBL8193759 | 0.77 | BCAT2 (0.40) | BCAT2BCAT1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6380134-B1 | USED FOR CONTROLLING WEEDS | SYNGENTA CROP PROTECTION, INC. | 2002-04-30 | — | — | US | disclosed |
| EP-1084117-A2 | NOVEL HERBICIDES | Novartis AG (CH) | 2001-03-21 | — | — | EP | disclosed |
| WO-1999052892-A2 | NOVEL HERBICIDES | NOVARTIS AG (CH) | 1999-10-21 | — | — | WO | disclosed |