Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IGF1R | P08069 | 4/20 | 0.45 |
| ▸ | RET | P07949 | 10/20 | 0.43 |
| ▸ | PLK1 | P53350 | 1/20 | 0.42 |
| ▸ | PLK3 | Q9H4B4 | 1/20 | 0.42 |
| ▸ | PLK2 | Q9NYY3 | 1/20 | 0.42 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.42 |
| ▸ | CDK2 | P24941 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 2/20 | 0.40 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.40 |
| ▸ | JAK3 | P52333 | 2/20 | 0.40 |
| ▸ | PTK2 | Q05397 | 2/20 | 0.40 |
| ▸ | AURKA | O14965 | 1/20 | 0.40 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.40 |
| ▸ | JAK2 | O60674 | 1/20 | 0.40 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.40 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.40 |
| ▸ | PAK4 | O96013 | 1/20 | 0.40 |
| ▸ | LCK | P06239 | 1/20 | 0.40 |
| ▸ | FYN | P06241 | 1/20 | 0.40 |
| ▸ | CSF1R | P07333 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL21600875 | 0.91 | PLK1 (0.42) | IGF1RRETPLK1PLK3PLK2 | |
| SCHEMBL21600870 | 0.91 | MAPK3 (0.40) | IGF1RRETPLK1PLK3PLK2 | |
| SCHEMBL21600800 | 0.87 | JAK3 (0.48) | IGF1RMAPK3JAK3FGFR1BTK | |
| SCHEMBL28909332 | 0.83 | IGF1R (0.52) | IGF1RPLK1PLK3PLK2CDK2 | |
| SCHEMBL21596373 | 0.83 | MAPK3 (0.47) | IGF1RRETPLK1PLK3PLK2 | |
| SCHEMBL21596407 | 0.83 | FLT3 (0.48) | IGF1RPLK1PLK3PLK2MAPK3 | |
| SCHEMBL21600829 | 0.83 | MAPK3 (0.46) | IGF1RRETPLK1PLK3PLK2 | |
| SCHEMBL21596372 | 0.82 | FLT3 (0.57) | IGF1RRETPLK1PLK3PLK2 | |
| SCHEMBL21596348 | 0.82 | ALK (0.54) | IGF1RRETPLK1MAPK3CDK2 | |
| SCHEMBL21600825 | 0.82 | EGFR (0.44) | IGF1RRETMAPK3CDK2GSK3B |
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 |