Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GCK | P35557 | 1/20 | 0.47 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.45 |
| ▸ | TRPA1 | O75762 | 12/20 | 0.41 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.41 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.41 |
| ▸ | RAF1 | P04049 | 1/20 | 0.41 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.41 |
| ▸ | HSPB1 | P04792 | 1/20 | 0.39 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28515229 | 0.78 | EPAS1 (0.44) | MAPK14TRPA1EPAS1HSPB1 | |
| SCHEMBL30194063 | 0.78 | EPAS1 (0.44) | MAPK14TRPA1EPAS1HSPB1 | |
| SCHEMBL28520346 | 0.75 | AR (0.44) | TRPA1EPAS1SLC22A12HSPB1 | |
| SCHEMBL30194117 | 0.75 | AR (0.44) | TRPA1EPAS1SLC22A12HSPB1 | |
| SCHEMBL30194013 | 0.75 | EPAS1 (0.41) | MAPK14TRPA1EPAS1HSPB1 | |
| SCHEMBL21652833 | 0.72 | EPAS1 (0.47) | MAPK14TRPA1EPAS1HSPB1 | |
| SCHEMBL27030772 | 0.72 | GCK (0.39) | GCK | |
| SCHEMBL28511624 | 0.72 | L3MBTL1 (0.49) | TRPA1EPAS1HSPB1 | |
| SCHEMBL30194076 | 0.72 | L3MBTL1 (0.49) | TRPA1EPAS1HSPB1 | |
| SCHEMBL3862799 | 0.71 | MAPK14 (0.51) | MAPK14TRPA1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-112300154-B | Nitrogen-containing heterocyclic compound, preparation method and application thereof | 上海弘翊生物科技有限公司 | 2023-01-24 | — | — | CN | disclosed |
| CN-112300154-A | Nitrogen-containing heterocyclic compound, preparation method and application thereof | 上海弘翊生物科技有限公司 | 2021-02-02 | — | — | CN | disclosed |