Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 3/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | ALDH1A2 | O94788 | 1/20 | 0.36 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.36 |
| ▸ | PDE1A | P54750 | 1/20 | 0.36 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.36 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.36 |
| ▸ | MERTK | Q12866 | 6/20 | 0.34 |
| ▸ | AXL | P30530 | 3/20 | 0.34 |
| ▸ | TYRO3 | Q06418 | 2/20 | 0.33 |
| ▸ | YTHDC1 | Q96MU7 | 1/20 | 0.32 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.32 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.32 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | PDE2A | O00408 | 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 | |
|---|---|---|---|---|
| SCHEMBL29174854 | 1.00 | ADORA2A (0.38) | ADORA2AADORA1ALDH1A1ALDH1A2ALDH1A3 | |
| SCHEMBL30095986 | 0.85 | ADORA2A (0.39) | ADORA2AADORA1ALDH1A1ALDH1A2ALDH1A3 | |
| SCHEMBL25876067 | 0.82 | PDE1A (0.41) | ADORA2AADORA1ALDH1A1ALDH1A2ALDH1A3 | |
| SCHEMBL30095812 | 0.81 | ADORA2A (0.37) | ADORA2AADORA1ALDH1A1ALDH1A2ALDH1A3 | |
| SCHEMBL29174959 | 0.81 | ADORA2A (0.37) | ADORA2AADORA1ALDH1A1ALDH1A2ALDH1A3 | |
| SCHEMBL31051052 | 0.78 | ADORA3 (0.41) | ADORA2AADORA1ALDH1A1GAAPDE2A | |
| SCHEMBL21481598 | 0.77 | ADORA2A (0.39) | ADORA2AADORA1ALDH1A1ALDH1A2ALDH1A3 | |
| SCHEMBL24955764 | 0.76 | CNR2 (0.35) | ADORA2AADORA1ALDH1A1ALDH1A2ALDH1A3 | |
| SCHEMBL31106977 | 0.76 | CNR2 (0.35) | ADORA2AADORA1ALDH1A1ALDH1A2ALDH1A3 | |
| SCHEMBL30095674 | 0.76 | SIGMAR1 (0.39) | ALDH1A1PKM |
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-117529315-A | Imidazole-containing ALK2 kinase inhibitors | 生物水晶制药公司 | 2024-02-06 | — | — | CN | disclosed |