Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 4/20 | 0.47 |
| ▸ | AURKA | O14965 | 3/20 | 0.47 |
| ▸ | GSK3A | P49840 | 3/20 | 0.47 |
| ▸ | SYK | P43405 | 2/20 | 0.43 |
| ▸ | PLK1 | P53350 | 1/20 | 0.41 |
| ▸ | KDR | P35968 | 3/20 | 0.39 |
| ▸ | CDK1 | P06493 | 3/20 | 0.38 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | EGFR | P00533 | 2/20 | 0.37 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.37 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.36 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.36 |
| ▸ | WNK1 | Q9H4A3 | 1/20 | 0.36 |
| ▸ | CDK2 | P24941 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL21600780 | 0.89 | GSK3B (0.45) | GSK3BAURKAGSK3ASYKPLK1 | |
| SCHEMBL21596390 | 0.83 | AURKA (0.58) | GSK3BAURKAGSK3ASYKPLK1 | |
| SCHEMBL30379300 | 0.83 | AURKA (0.58) | GSK3BAURKAGSK3ASYKPLK1 | |
| SCHEMBL21596355 | 0.81 | SYK (0.44) | GSK3BAURKAGSK3ASYKPLK1 | |
| SCHEMBL30380004 | 0.77 | GSK3B (0.54) | GSK3BAURKAGSK3ASYKPLK1 | |
| SCHEMBL21596344 | 0.77 | GSK3B (0.54) | GSK3BAURKAGSK3ASYKPLK1 | |
| SCHEMBL30380205 | 0.76 | CDK1 (0.55) | GSK3BAURKAKDRCDK1EGFR | |
| SCHEMBL21596346 | 0.76 | CDK1 (0.55) | GSK3BAURKAKDRCDK1EGFR | |
| SCHEMBL28529178 | 0.75 | SYK (0.39) | GSK3BAURKAGSK3ASYKKDR | |
| SCHEMBL441088 | 0.71 | AURKA (0.73) | GSK3BAURKAGSK3ASYKPLK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019242689-A1 | CYANO-SUBSTITUTED PYRIDINE AND CYANO-SUBSTITUTED PYRIMIDINE COMPOUND, AND PREPARATION METHOD AND APPLICATION THEREOF | 北京赛特明强医药科技有限公司 | 2019-12-26 | — | — | WO | disclosed |