Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LRRK2 | Q5S007 | 17/20 | 0.38 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.35 |
| ▸ | CDK2 | P24941 | 1/20 | 0.35 |
| ▸ | TTK | P33981 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL22300597 | 0.77 | LRRK2 (0.52) | LRRK2CYP1A2 | |
| SCHEMBL22299742 | 0.74 | LRRK2 (0.47) | LRRK2CYP1A2 | |
| SCHEMBL4561017 | 0.73 | LRRK2 (0.70) | LRRK2CYP1A2 | |
| SCHEMBL22288293 | 0.72 | MAPK1 (0.45) | LRRK2CYP1A2 | |
| SCHEMBL25027397 | 0.69 | CDK2 (0.32) | CDK2 | |
| SCHEMBL21046862 | 0.67 | LRRK2 (0.50) | LRRK2CDK2 | |
| SCHEMBL28442602 | 0.67 | LRRK2 (0.61) | LRRK2CDK2 | |
| SCHEMBL28439201 | 0.64 | LRRK2 (0.48) | LRRK2CDK2 | |
| SCHEMBL6910207 | 0.63 | MAP4K4 (0.40) | CDK2PDE10A | |
| SCHEMBL31010389 | 0.63 | LMNA (0.33) | CDK2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111484482-B | Alkynyl pyrimidine or alkynyl pyridine compound, and composition and application thereof | 北京赛特明强医药科技有限公司 | 2022-06-21 | — | — | CN | disclosed |
| WO-2020156283-A1 | ALKYNYLPYRIMIDINE OR ALKYNYLPYRIDINE COMPOUND, AND COMPOSITION AND APPLICATION THEREOF | 北京赛特明强医药科技有限公司 | 2020-08-06 | — | — | WO | disclosed |
| WO-2020156283-A1 | ALKYNYLPYRIMIDINE OR ALKYNYLPYRIDINE COMPOUND, AND COMPOSITION AND APPLICATION THEREOF | 北京赛特明强医药科技有限公司 | 2020-08-06 | — | — | WO | disclosed |
| CN-111484482-A | Alkynyl pyrimidine or alkynyl pyridine compound, and composition and application thereof | 北京赛特明强医药科技有限公司 | 2020-08-04 | — | — | CN | disclosed |