Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RET | P07949 | 2/20 | 0.47 |
| ▸ | ITK | Q08881 | 13/20 | 0.47 |
| ▸ | BTK | Q06187 | 4/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.47 |
| ▸ | EGFR | P00533 | 7/20 | 0.45 |
| ▸ | JAK3 | P52333 | 2/20 | 0.45 |
| ▸ | TEC | P42680 | 2/20 | 0.43 |
| ▸ | TXK | P42681 | 2/20 | 0.43 |
| ▸ | BMX | P51813 | 2/20 | 0.43 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.43 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.43 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.43 |
| ▸ | LATS1 | O95835 | 1/20 | 0.43 |
| ▸ | NUDT14 | O95848 | 1/20 | 0.43 |
| ▸ | ABL1 | P00519 | 1/20 | 0.43 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.43 |
| ▸ | LCK | P06239 | 1/20 | 0.43 |
| ▸ | FYN | P06241 | 1/20 | 0.43 |
| ▸ | PGR | P06401 | 1/20 | 0.43 |
| ▸ | CSF1R | P07333 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL19256930 | 0.87 | ITK (0.62) | ITKBTKKCNH2EGFRJAK3 | |
| SCHEMBL28516121 | 0.87 | ITK (0.62) | ITKBTKKCNH2EGFRJAK3 | |
| SCHEMBL19256932 | 0.81 | EGFR (0.69) | RETITKBTKKCNH2EGFR | |
| SCHEMBL19257300 | 0.79 | ITK (0.61) | ITKBTKKCNH2EGFR | |
| SCHEMBL28520057 | 0.79 | ITK (0.61) | ITKBTKKCNH2EGFR | |
| SCHEMBL19256963 | 0.79 | EGFR (0.51) | RETITKBTKKCNH2EGFR | |
| SCHEMBL19257299 | 0.76 | EGFR (0.65) | RETITKBTKKCNH2EGFR | |
| SCHEMBL28512491 | 0.76 | EGFR (0.65) | RETITKBTKKCNH2EGFR | |
| SCHEMBL19256929 | 0.75 | ITK (0.65) | ITKBTKKCNH2EGFR | |
| SCHEMBL28528769 | 0.75 | ITK (0.65) | ITKBTKKCNH2EGFR |
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-2017133630-A1 | INHIBITOR OF BRUTON'S TYROSINE KINASE | 北京盛诺基医药科技有限公司 | 2017-08-10 | — | — | WO | disclosed |