Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR3 | P49019 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.41 |
| ▸ | MALT1 | Q9UDY8 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | AOC1 | P19801 | 1/20 | 0.39 |
| ▸ | SYK | P43405 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | DRD3 | P35462 | 1/20 | 0.37 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.37 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL22877113 | 0.92 | KDM4E (0.50) | HCAR3ALDH1A1KDM4EL3MBTL1MEN1 | |
| SCHEMBL5847287 | 0.92 | KDM4E (0.46) | HCAR3ALDH1A1KDM4EL3MBTL1HPGD | |
| SCHEMBL31057008 | 0.91 | SYK (0.47) | HCAR3SYKROCK2ROCK1 | |
| SCHEMBL26814095 | 0.91 | SYK (0.47) | HCAR3SYKROCK2ROCK1 | |
| SCHEMBL9901706 | 0.90 | KDM4E (0.53) | HCAR3ALDH1A1KDM4EL3MBTL1MEN1 | |
| SCHEMBL30183229 | 0.90 | KDM4E (0.53) | HCAR3ALDH1A1KDM4EL3MBTL1MEN1 | |
| SCHEMBL30182919 | 0.90 | KDM4E (0.53) | HCAR3ALDH1A1KDM4EL3MBTL1MEN1 | |
| SCHEMBL13326729 | 0.87 | HRH3 (0.51) | ALDH1A1MEN1KMT2AROCK2ROCK1 | |
| SCHEMBL28179313 | 0.86 | GBA1 (0.43) | ALDH1A1KDM4EL3MBTL1 | |
| SCHEMBL28179312 | 0.86 | GBA1 (0.43) | ALDH1A1KDM4EL3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023017937-A1 | NOVEL INHIBITOR FOR MULTIPLE PROTEIN KINASES | 계명대학교 산학협력단 | 2023-02-16 | — | — | WO | disclosed |
| CN-105960404-B | The inhibitor of bruton's tyrosine kinase | 药品循环有限责任公司 | 2019-09-03 | — | — | CN | disclosed |
| EP-2545042-A1 | COMPOUNDS FOR THE TREATMENT OF HEPATITIS C | Bristol-Myers Squibb Company (US) | 2013-01-16 | — | — | EP | disclosed |
| WO-2011112191-A1 | COMPOUNDS FOR THE TREATMENT OF HEPATITIS C | BRISTOL-MYERS SQUIBB COMPANY (US) | 2011-09-15 | — | — | WO | disclosed |