Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH3 | Q9ULD8 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | JAK2 | O60674 | 1/20 | 0.34 |
| ▸ | JAK3 | P52333 | 1/20 | 0.34 |
| ▸ | FLT3 | P36888 | 1/20 | 0.34 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.33 |
| ▸ | CSF1R | P07333 | 1/20 | 0.33 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.32 |
| ▸ | IRAK1 | P51617 | 1/20 | 0.31 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.31 |
| ▸ | MERTK | Q12866 | 2/20 | 0.31 |
| ▸ | VCP | P55072 | 2/20 | 0.31 |
| ▸ | VNN1 | O95497 | 1/20 | 0.31 |
| ▸ | TRIM58 | Q8NG06 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL31229559 | 0.85 | ALDH1A1 (0.40) | KCNH3ALDH1A1TLR9HIF1ACSF1R | |
| SCHEMBL31229859 | 0.84 | TLR9 (0.39) | KCNH3ALDH1A1TLR9JAK3MERTK | |
| SCHEMBL31229821 | 0.72 | TLR9 (0.38) | TLR9JAK3VCP | |
| SCHEMBL31229803 | 0.71 | VCP (0.35) | ALDH1A1TLR9JAK2JAK3CSF1R | |
| SCHEMBL29167207 | 0.69 | KCNH3 (0.54) | KCNH3ALDH1A1PTGS1PTGS2HIF1A | |
| SCHEMBL29197980 | 0.69 | KCNH3 (0.54) | KCNH3ALDH1A1PTGS1PTGS2RIPK2 | |
| SCHEMBL1488097 | 0.65 | — | — | |
| SCHEMBL17164865 | 0.64 | KCNH3 (0.42) | KCNH3ALDH1A1PTGS1PTGS2HIF1A | |
| SCHEMBL9912549 | 0.62 | KCNH3 (0.49) | KCNH3ALDH1A1PTGS1PTGS2HIF1A | |
| SCHEMBL4439219 | 0.61 | HRH4 (0.36) | KCNH3ALDH1A1VCPTRIM58MAPK1 |
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-119161353-A | Design, synthesis and activity evaluation of pyranopyrimidine heterocyclic p97/VCP inhibitors | 首都医科大学 | 2024-12-20 | — | — | CN | disclosed |