Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 11/20 | 0.47 |
| ▸ | MAPK3 | P27361 | 9/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | INSR | P06213 | 1/20 | 0.42 |
| ▸ | IGF1R | P08069 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL21600938 | 0.96 | EGFR (0.50) | EGFRMAPK3MAPK1 | |
| SCHEMBL21600815 | 0.93 | MAPK3 (0.44) | EGFRMAPK3MAPK1 | |
| SCHEMBL28531630 | 0.93 | MAPK3 (0.51) | EGFRMAPK3MAPK1 | |
| SCHEMBL21600838 | 0.91 | MAPK3 (0.45) | EGFRMAPK3INSRIGF1RKCNH2 | |
| SCHEMBL21600878 | 0.89 | MAPK3 (0.43) | EGFRMAPK3INSRIGF1RKCNH2 | |
| SCHEMBL21596311 | 0.88 | MAPK3 (0.46) | MAPK3 | |
| SCHEMBL21600796 | 0.87 | EGFR (0.52) | EGFRMAPK3MAPK1INSRIGF1R | |
| SCHEMBL21600822 | 0.83 | EGFR (0.49) | EGFRMAPK3MAPK1INSRIGF1R | |
| SCHEMBL21596347 | 0.82 | PLK1 (0.56) | EGFRMAPK3MAPK1 | |
| SCHEMBL28525553 | 0.81 | EGFR (0.53) | EGFRMAPK3INSRIGF1RKCNH2 |
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-2019242689-A1 | CYANO-SUBSTITUTED PYRIDINE AND CYANO-SUBSTITUTED PYRIMIDINE COMPOUND, AND PREPARATION METHOD AND APPLICATION THEREOF | 北京赛特明强医药科技有限公司 | 2019-12-26 | — | — | WO | disclosed |