Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.47 |
| ▸ | HPGD | P15428 | 3/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.46 |
| ▸ | ALDH1A2 | O94788 | 2/20 | 0.45 |
| ▸ | ALDH2 | P05091 | 2/20 | 0.45 |
| ▸ | ALDH1B1 | P30837 | 2/20 | 0.45 |
| ▸ | ALDH1A3 | P47895 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | SRC | P12931 | 1/20 | 0.41 |
| ▸ | STS | P08842 | 1/20 | 0.41 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.41 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.41 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7811491 | 0.82 | CA12 (0.51) | ALDH1A1KDM4EHPGDRAB9AHSD17B10 | |
| SCHEMBL19908186 | 0.81 | MAPT (0.46) | NQO1ALDH1A1KDM4EHPGDRAB9A | |
| SCHEMBL7811513 | 0.77 | NQO1 (0.76) | NQO1ALDH1A1KDM4EHSD17B3ALDH1A2 | |
| SCHEMBL7806794 | 0.74 | ALDH1A1 (0.43) | ALDH1A1KDM4EHPGDRAB9AHSD17B10 | |
| SCHEMBL19908187 | 0.74 | MAPT (0.44) | NQO1ALDH1A1KDM4EHPGDRAB9A | |
| SCHEMBL19908166 | 0.74 | MAPT (0.50) | NQO1ALDH1A1KDM4EHPGDRAB9A | |
| SCHEMBL8714423 | 0.72 | NQO1 (0.46) | NQO1ALDH1A1KDM4EHPGDRAB9A | |
| SCHEMBL7811453 | 0.72 | HSD17B3 (0.46) | ALDH1A1KDM4EHPGDRAB9AHSD17B10 | |
| SCHEMBL12369514 | 0.71 | NQO1 (0.62) | NQO1ALDH1A1KDM4EHPGDRAB9A | |
| SCHEMBL7811499 | 0.70 | CA12 (0.48) | ALDH1A1KDM4EHSD17B3MAOAMAOB |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0861242-B1 | HETEROCYCLIC FUNGICIDES | AVENTIS CROPSCIENCE UK LTD (GB) | 2001-05-30 | — | — | EP | disclosed |
| US-6034121-A | AGRICULTURE | AGREVO UK LIMITED (GB) | 2000-03-07 | — | — | US | disclosed |
| EP-0861242-A1 | HETEROCYCLIC FUNGICIDES | AgrEvo UK Limited (GB) | 1998-09-02 | — | — | EP | disclosed |
| WO-1997013762-A1 | HETEROCYCLIC FUNGICIDES | AGREVO UK LIMITED (GB) | 1997-04-17 | — | — | WO | disclosed |