Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAF1 | P04049 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.33 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.33 |
| ▸ | PLK1 | P53350 | 2/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.32 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.32 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.32 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.32 |
| ▸ | SPR | P35270 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.30 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.30 |
| ▸ | CNR1 | P21554 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.30 |
| ▸ | SIRT3 | Q9NTG7 | 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 | |
|---|---|---|---|---|
| SCHEMBL20518840 | 1.00 | RAF1 (0.35) | RAF1GAANUDT1MAP4K1PLK1 | |
| SCHEMBL30107394 | 0.80 | RAF1 (0.33) | RAF1GAANUDT1MAP4K1PLK1 | |
| SCHEMBL23898681 | 0.79 | ATM (0.43) | GAALMNAMAPK1 | |
| SCHEMBL20519828 | 0.76 | NPC1 (0.39) | RAF1GAANUDT1MAP4K1PLK1 | |
| SCHEMBL28681748 | 0.73 | PLK1 (0.49) | GAAPLK1LMNACYP1A2CYP3A4 | |
| SCHEMBL20518940 | 0.69 | AOC1 (0.39) | — | |
| SCHEMBL2005686 | 0.69 | SIRT3 (0.38) | RAF1GAANUDT1MAP4K1PLK1 | |
| SCHEMBL26521598 | 0.68 | CCR1 (0.30) | — | |
| SCHEMBL30107188 | 0.67 | SIRT3 (0.61) | GAANUDT1CASP1MKNK1MKNK2 | |
| SCHEMBL13162016 | 0.67 | SIRT3 (0.61) | GAANUDT1CASP1MKNK1MKNK2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-110678466-B | Diazanaphthalenes as HPK1 inhibitors | 豪夫迈·罗氏有限公司 | 2023-01-31 | — | — | CN | disclosed |