Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 17/20 | 0.68 |
| ▸ | BLK | P51451 | 2/20 | 0.60 |
| ▸ | EGFR | P00533 | 5/20 | 0.56 |
| ▸ | ITK | Q08881 | 4/20 | 0.56 |
| ▸ | TEC | P42680 | 3/20 | 0.56 |
| ▸ | BMX | P51813 | 3/20 | 0.56 |
| ▸ | TXK | P42681 | 2/20 | 0.56 |
| ▸ | LYN | P07948 | 2/20 | 0.56 |
| ▸ | FGFR2 | P21802 | 2/20 | 0.56 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.56 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.56 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.56 |
| ▸ | LATS1 | O95835 | 1/20 | 0.56 |
| ▸ | NUDT14 | O95848 | 1/20 | 0.56 |
| ▸ | ABL1 | P00519 | 1/20 | 0.56 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.56 |
| ▸ | LCK | P06239 | 1/20 | 0.56 |
| ▸ | FYN | P06241 | 1/20 | 0.56 |
| ▸ | PGR | P06401 | 1/20 | 0.56 |
| ▸ | CSF1R | P07333 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL19635206 | 1.00 | BTK (0.68) | BTKBLKEGFRITKTEC | |
| SCHEMBL19635642 | 0.90 | BTK (0.58) | BTKBLKEGFRITKLCK | |
| SCHEMBL19635646 | 0.90 | BTK (0.58) | BTKBLKEGFRITKLCK | |
| SCHEMBL19635644 | 0.90 | BTK (0.58) | BTKBLKEGFRITKLCK | |
| SCHEMBL19635209 | 0.87 | BTK (0.62) | BTKBLKEGFRITKLCK | |
| SCHEMBL19635207 | 0.87 | BTK (0.62) | BTKBLKEGFRITKLCK | |
| SCHEMBL19635661 | 0.86 | BTK (0.54) | BTKBLKEGFRITKLCK | |
| SCHEMBL19635662 | 0.86 | BTK (0.54) | BTKBLKEGFRITKLCK | |
| SCHEMBL19635194 | 0.85 | BTK (0.69) | BTKBLKEGFRITKTEC | |
| SCHEMBL19635188 | 0.85 | BTK (0.69) | BTKBLKEGFRITKTEC |
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 |