Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 14/20 | 0.72 |
| ▸ | EGFR | P00533 | 15/20 | 0.53 |
| ▸ | JAK3 | P52333 | 1/20 | 0.48 |
| ▸ | BMX | P51813 | 1/20 | 0.46 |
| ▸ | ITK | Q08881 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL22296402 | 0.91 | BTK (0.60) | BTKEGFRJAK3BMX | |
| SCHEMBL23866046 | 0.91 | BTK (0.72) | BTKEGFRJAK3BMXITK | |
| SCHEMBL23866197 | 0.91 | BTK (0.72) | BTKEGFRJAK3BMXITK | |
| SCHEMBL22296416 | 0.89 | BTK (0.58) | BTKEGFRJAK3BMXITK | |
| SCHEMBL22296400 | 0.85 | BTK (0.64) | BTKEGFRJAK3BMXITK | |
| SCHEMBL22222601 | 0.84 | BTK (1.00) | BTKEGFR | |
| SCHEMBL22296205 | 0.80 | BTK (0.58) | BTKEGFRJAK3 | |
| SCHEMBL22296206 | 0.80 | BTK (0.73) | BTKEGFRJAK3 | |
| SCHEMBL22296211 | 0.78 | BTK (0.67) | BTKEGFRJAK3 | |
| SCHEMBL22296421 | 0.78 | BTK (0.72) | BTKEGFRJAK3BMX |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3689871-B1 | 4,6,7-TRISUBSTITUTED 1,2-DIHYDROPYRROL[3,4-C]PYRIDIN/PYRIMIDIN-3-ONE DERIVATIVE AND USE | SHANGHAI HAIYAN PHARMACEUTICAL TECH CO LTD (CN) | 2021-09-29 | — | — | EP | disclosed |
| EP-3689871-A1 | 4,6,7-TRISUBSTITUTED 1,2-DIHYDROPYRROL[3,4-C]PYRIDIN/PYRIMIDIN-3-ONE DERIVATIVE AND USE | Shanghai Haiyan Pharmaceutical Technology Co., Ltd. (CN) | 2020-08-05 | — | — | EP | disclosed |