Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CLK4 | Q9HAZ1 | 4/20 | 0.39 |
| ▸ | CLK1 | P49759 | 3/20 | 0.39 |
| ▸ | CLK2 | P49760 | 3/20 | 0.39 |
| ▸ | DYRK1B | Q9Y463 | 3/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 9/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 6/20 | 0.36 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.36 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.35 |
| ▸ | CDK2 | P24941 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL22179732 | 1.00 | CLK4 (0.39) | CLK4CLK1CLK2DYRK1BADORA2A | |
| SCHEMBL21621296 | 0.83 | ADORA2A (0.48) | CLK4ADORA2ALMNATDP1ADORA1 | |
| SCHEMBL29947005 | 0.83 | ADORA1 (0.39) | CLK4CLK1CLK2DYRK1BADORA2A | |
| SCHEMBL21621287 | 0.83 | ADORA1 (0.39) | CLK4CLK1CLK2DYRK1BADORA2A | |
| SCHEMBL20392542 | 0.81 | ADORA2A (0.56) | ADORA2AADORA1MAP4K4ADORA2B | |
| SCHEMBL20392590 | 0.80 | ADORA2A (0.59) | ADORA2AADORA1MAP4K4ADORA2B | |
| SCHEMBL20392686 | 0.80 | ADORA2A (0.59) | CLK4ADORA2ALMNAADORA1MAP4K4 | |
| SCHEMBL30738319 | 0.80 | ADORA2A (0.59) | CLK4ADORA2ALMNAADORA1MAP4K4 | |
| SCHEMBL20392695 | 0.76 | ADORA2A (0.44) | CLK1ADORA2AADORA1MAP4K4ADORA2B | |
| SCHEMBL21569365 | 0.73 | ADORA2A (0.52) | ADORA2AADORA1MAP4K4ADORA2B |
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-113166119-B | Substituted aryl compound and preparation method and application thereof | 四川科伦博泰生物医药股份有限公司 | 2024-01-05 | — | — | CN | disclosed |