Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 2/20 | 0.47 |
| ▸ | GSK3A | P49840 | 7/20 | 0.47 |
| ▸ | GSK3B | P49841 | 7/20 | 0.47 |
| ▸ | EGFR | P00533 | 2/20 | 0.45 |
| ▸ | BTK | Q06187 | 1/20 | 0.45 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.44 |
| ▸ | PRKAB2 | O43741 | 2/20 | 0.44 |
| ▸ | PRKAG1 | P54619 | 2/20 | 0.44 |
| ▸ | PRKAA2 | P54646 | 2/20 | 0.44 |
| ▸ | PRKAA1 | Q13131 | 2/20 | 0.44 |
| ▸ | PRKAG3 | Q9UGI9 | 2/20 | 0.44 |
| ▸ | PRKAG2 | Q9UGJ0 | 2/20 | 0.44 |
| ▸ | PRKAB1 | Q9Y478 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.42 |
| ▸ | CDK2 | P24941 | 2/20 | 0.42 |
| ▸ | CCNA1 | P78396 | 2/20 | 0.42 |
| ▸ | AURKA | O14965 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL25311831 | 0.93 | EPHX2 (0.44) | EPHX2GSK3AGSK3BEGFRBTK | |
| SCHEMBL25312534 | 0.93 | EPHX2 (0.47) | EPHX2GSK3AGSK3BEGFRBTK | |
| SCHEMBL29466315 | 0.93 | EPHX2 (0.47) | EPHX2GSK3AGSK3BEGFRBTK | |
| SCHEMBL25311631 | 0.92 | EPHX2 (0.48) | EPHX2GSK3AGSK3BEGFRBTK | |
| SCHEMBL29466335 | 0.86 | GSK3A (0.50) | GSK3AGSK3BEGFRCDK2AURKA | |
| SCHEMBL25882561 | 0.86 | GSK3A (0.50) | GSK3AGSK3BEGFRCDK2AURKA | |
| SCHEMBL25311993 | 0.85 | GSK3A (0.44) | GSK3AGSK3BEGFRBTKMEN1 | |
| SCHEMBL29484598 | 0.85 | NAMPT (0.50) | EPHX2CCNA2CDK2CCNA1 | |
| SCHEMBL29484607 | 0.85 | NAMPT (0.50) | EPHX2CCNA2CDK2CCNA1 | |
| SCHEMBL25882312 | 0.85 | NAMPT (0.50) | EPHX2CCNA2CDK2CCNA1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4215526-A1 | CARBONYL HETEROCYCLIC COMPOUND AND APPLICATION THEREOF | Shanghai Pharmaceuticals Holding Co., Ltd. (CN) | 2023-07-26 | — | — | EP | disclosed |