Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 1/20 | 0.43 |
| ▸ | TPX2 | Q9ULW0 | 1/20 | 0.43 |
| ▸ | WDR5 | P61964 | 1/20 | 0.39 |
| ▸ | MRGPRX4 | Q96LA9 | 2/20 | 0.38 |
| ▸ | FAAH | O00519 | 1/20 | 0.37 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.37 |
| ▸ | PPARA | Q07869 | 1/20 | 0.36 |
| ▸ | PIM1 | P11309 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | MITF | O75030 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | MEP1B | Q16820 | 1/20 | 0.33 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.33 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.33 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL22926044 | 0.86 | AURKA (0.44) | AURKATPX2WDR5MRGPRX4FAAH | |
| SCHEMBL31550001 | 0.80 | AURKA (0.56) | AURKATPX2WDR5MRGPRX4FAAH | |
| SCHEMBL475754 | 0.80 | AURKA (0.56) | AURKATPX2WDR5MRGPRX4FAAH | |
| SCHEMBL11816991 | 0.77 | MRGPRX4 (0.46) | AURKATPX2WDR5MRGPRX4PPARA | |
| SCHEMBL21609791 | 0.76 | CES2 (0.44) | MRGPRX4GAAAKR1C2 | |
| SCHEMBL23977148 | 0.76 | TPMT (0.52) | WDR5 | |
| SCHEMBL11818965 | 0.74 | PPARA (0.39) | AURKATPX2WDR5MRGPRX4PPARA | |
| SCHEMBL29728998 | 0.74 | AURKA (0.67) | AURKATPX2WDR5MRGPRX4FAAH | |
| SCHEMBL2567096 | 0.74 | AURKA (0.67) | AURKATPX2WDR5MRGPRX4FAAH | |
| SCHEMBL11817579 | 0.72 | AURKA (0.49) | AURKATPX2WDR5MRGPRX4FAAH |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021224323-A1 | NOVEL HETEROARYL-TRIAZOLE COMPOUNDS AS PESTICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 2021-11-11 | — | — | WO | disclosed |