Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 3/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | DDX3X | O00571 | 1/20 | 0.47 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | PLK1 | P53350 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | CYP4Z1 | Q86W10 | 1/20 | 0.43 |
| ▸ | CYP4F11 | Q9HBI6 | 1/20 | 0.43 |
| ▸ | CYP4F12 | Q9HCS2 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4393968 | 0.88 | ESR1 (0.51) | POLBCYP3A4CYP2D6CYP2C9SKP2 | |
| SCHEMBL29715987 | 0.88 | ESR1 (0.51) | POLBCYP3A4CYP2D6CYP2C9SKP2 | |
| SCHEMBL15782005 | 0.85 | HSD17B10 (0.50) | CYP2D6ALDH1A1HPGDMAPK1HSD17B10 | |
| SCHEMBL6581850 | 0.83 | ALDH1A1 (0.52) | POLBCYP3A4CYP2D6ALDH1A1HPGD | |
| SCHEMBL3072732 | 0.80 | ALDH1A1 (0.52) | POLBCYP3A4CYP2D6ALDH1A1HPGD | |
| SCHEMBL12598866 | 0.80 | CA1 (0.50) | POLBSKP2ALDH1A1HPGDPLK1 | |
| SCHEMBL2748823 | 0.80 | CA1 (0.49) | POLBALDH1A1HPGDPLK1MAPT | |
| SCHEMBL13190946 | 0.79 | ALDH1A1 (0.50) | POLBCYP3A4CYP2D6ALDH1A1HPGD | |
| SCHEMBL24220468 | 0.78 | SKP2 (0.53) | POLBCYP3A4CYP2D6CYP2C9SKP2 | |
| SCHEMBL6370474 | 0.78 | ALDH1A1 (0.48) | ALDH1A1PLK1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2260032-A2 | FUNGICIDAL HETERCYCLIC COMPOUNDS | E. I. du Pont de Nemours and Company (US) | 2010-12-15 | — | — | EP | disclosed |
| WO-2009094445-A2 | FUNGICIDAL HETERCYCLIC COMPOUNDS | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2009-07-30 | — | — | WO | disclosed |