Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 20/20 | 0.62 |
| ▸ | LYN | P07948 | 3/20 | 0.62 |
| ▸ | LCK | P06239 | 2/20 | 0.62 |
| ▸ | EGFR | P00533 | 4/20 | 0.62 |
| ▸ | TEC | P42680 | 3/20 | 0.62 |
| ▸ | BMX | P51813 | 3/20 | 0.62 |
| ▸ | TXK | P42681 | 2/20 | 0.62 |
| ▸ | FGFR2 | P21802 | 2/20 | 0.62 |
| ▸ | ITK | Q08881 | 2/20 | 0.62 |
| ▸ | BLK | P51451 | 2/20 | 0.62 |
| ▸ | NUDT14 | O95848 | 2/20 | 0.62 |
| ▸ | NUDT5 | Q9UKK9 | 2/20 | 0.62 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.62 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.62 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.62 |
| ▸ | LATS1 | O95835 | 1/20 | 0.62 |
| ▸ | ABL1 | P00519 | 1/20 | 0.62 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.62 |
| ▸ | FYN | P06241 | 1/20 | 0.62 |
| ▸ | PGR | P06401 | 1/20 | 0.62 |
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 | |
|---|---|---|---|---|
| SCHEMBL18493108 | 0.90 | BTK (0.73) | BTKLYNLCKEGFRTEC | |
| SCHEMBL21398244 | 0.90 | BTK (0.73) | BTKLYNLCKEGFRTEC | |
| SCHEMBL20223313 | 0.85 | BTK (0.72) | BTKLYNLCKEGFRTEC | |
| SCHEMBL19519589 | 0.81 | BTK (0.71) | BTKLYNLCKEGFRTEC | |
| SCHEMBL19831569 | 0.80 | BTK (0.70) | BTKLYNLCKEGFRTEC | |
| SCHEMBL22625403 | 0.79 | BTK (0.71) | BTKLYNLCKEGFRTEC | |
| SCHEMBL4910818 | 0.79 | BTK (0.79) | BTKLYNLCKEGFRTEC | |
| SCHEMBL23409076 | 0.78 | BTK (0.74) | BTKLYNLCKEGFRTEC | |
| SCHEMBL24827796 | 0.78 | BTK (0.74) | BTKLYNLCKEGFRTEC | |
| SCHEMBL6431516 | 0.78 | BTK (1.00) | BTKLYNLCKEGFRTEC |
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-2017124657-A1 | BRUTON'S TYROSINE KINASE INHIBITOR HAVING SPIRAL OR BRIDGED RING STRUCTURE AND PREPARATION METHOD THEREOF | 成都倍特药业有限公司 | 2017-07-27 | — | — | WO | disclosed |