Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 20/20 | 0.55 |
| ▸ | BLK | P51451 | 2/20 | 0.49 |
| ▸ | EGFR | P00533 | 1/20 | 0.49 |
| ▸ | LCK | P06239 | 1/20 | 0.49 |
| ▸ | LYN | P07948 | 1/20 | 0.49 |
| ▸ | FGR | P09769 | 1/20 | 0.47 |
| ▸ | FLT3 | P36888 | 1/20 | 0.47 |
| ▸ | CSK | P41240 | 1/20 | 0.47 |
| ▸ | JAK3 | P52333 | 1/20 | 0.47 |
| ▸ | ITK | Q08881 | 1/20 | 0.47 |
| ▸ | NUDT14 | O95848 | 1/20 | 0.46 |
| ▸ | NUDT5 | Q9UKK9 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL19635645 | 1.00 | BTK (0.55) | BTKBLKEGFRLCKLYN | |
| SCHEMBL19635641 | 1.00 | BTK (0.55) | BTKBLKEGFRLCKLYN | |
| SCHEMBL19635669 | 0.86 | BTK (0.66) | BTKBLKEGFRLCKLYN | |
| SCHEMBL19635798 | 0.86 | BTK (0.61) | BTKBLKEGFRLCKLYN | |
| SCHEMBL19635793 | 0.86 | BTK (0.61) | BTKBLKEGFRLCKLYN | |
| SCHEMBL19635799 | 0.86 | BTK (0.61) | BTKBLKEGFRLCKLYN | |
| SCHEMBL19635667 | 0.85 | BTK (0.56) | BTKBLKEGFRLCKLYN | |
| SCHEMBL19635789 | 0.84 | BTK (0.68) | BTKBLKEGFRLCKLYN | |
| SCHEMBL19636020 | 0.84 | BTK (0.68) | BTKBLKEGFRLCKLYN | |
| SCHEMBL19635663 | 0.84 | JAK2 (0.59) | BTKBLKEGFRLCKLYN |
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-2017198049-A1 | PYRAZOLOPYRIMIDINE DERIVATIVE AS BTK INHIBITOR AND PREPARATION METHOD AND PHARMACEUTICAL COMPOSITION THEREOF | 浙江予川医药科技有限公司 | 2017-11-23 | — | — | WO | disclosed |