Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | WEE1 | P30291 | 5/20 | 0.65 |
| ▸ | ALK | Q9UM73 | 5/20 | 0.65 |
| ▸ | PTK2 | Q05397 | 4/20 | 0.65 |
| ▸ | PDGFRA | P16234 | 3/20 | 0.65 |
| ▸ | AURKA | O14965 | 3/20 | 0.65 |
| ▸ | DAPK3 | O43293 | 2/20 | 0.65 |
| ▸ | JAK2 | O60674 | 2/20 | 0.65 |
| ▸ | PRKD3 | O94806 | 2/20 | 0.65 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.65 |
| ▸ | PAK4 | O96013 | 2/20 | 0.65 |
| ▸ | LCK | P06239 | 2/20 | 0.65 |
| ▸ | FYN | P06241 | 2/20 | 0.65 |
| ▸ | CSF1R | P07333 | 2/20 | 0.65 |
| ▸ | RET | P07949 | 2/20 | 0.65 |
| ▸ | IGF1R | P08069 | 2/20 | 0.65 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.65 |
| ▸ | PRKACA | P17612 | 2/20 | 0.65 |
| ▸ | FLT1 | P17948 | 2/20 | 0.65 |
| ▸ | LTK | P29376 | 2/20 | 0.65 |
| ▸ | KDR | P35968 | 2/20 | 0.65 |
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 | |
|---|---|---|---|---|
| SCHEMBL21596309 | 0.81 | JAK3 (0.54) | WEE1ALKPTK2PDGFRAAURKA | |
| SCHEMBL21600829 | 0.79 | MAPK3 (0.46) | WEE1ALKPTK2PDGFRAAURKA | |
| SCHEMBL3714937 | 0.79 | PDGFRA (1.00) | WEE1ALKPTK2PDGFRAAURKA | |
| SCHEMBL4772582 | 0.76 | AURKA (0.52) | PTK2AURKAKDRMAPK8MAPK9 | |
| SCHEMBL2482380 | 0.75 | SLC2A1 (0.65) | WEE1ALKPTK2PDGFRAAURKA | |
| SCHEMBL30560068 | 0.74 | PTK2 (0.52) | WEE1ALKPTK2PDGFRAAURKA | |
| SCHEMBL21599134 | 0.74 | ALK (0.59) | WEE1ALKPTK2PDGFRAAURKA | |
| SCHEMBL28525616 | 0.73 | WEE1 (0.57) | WEE1ALKPTK2PDGFRAAURKA | |
| SCHEMBL21596340 | 0.72 | FLT3 (0.77) | WEE1ALKPTK2PDGFRAAURKA | |
| SCHEMBL29310350 | 0.72 | SLC2A1 (0.60) | WEE1ALKPTK2PDGFRAAURKA |
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 |