Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALK | Q9UM73 | 8/20 | 0.68 |
| ▸ | PTK2 | Q05397 | 6/20 | 0.68 |
| ▸ | INSR | P06213 | 3/20 | 0.68 |
| ▸ | AURKA | O14965 | 2/20 | 0.68 |
| ▸ | MET | P08581 | 2/20 | 0.68 |
| ▸ | MAPK9 | P45984 | 2/20 | 0.68 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.68 |
| ▸ | CDC7 | O00311 | 1/20 | 0.68 |
| ▸ | PLK4 | O00444 | 1/20 | 0.68 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.68 |
| ▸ | DCLK1 | O15075 | 1/20 | 0.68 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.68 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.68 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.68 |
| ▸ | JAK2 | O60674 | 1/20 | 0.68 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.68 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.68 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.68 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.68 |
| ▸ | PAK4 | O96013 | 1/20 | 0.68 |
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 | |
|---|---|---|---|---|
| SCHEMBL25299781 | 0.84 | PTK2 (0.65) | ALKPTK2INSRAURKAMET | |
| SCHEMBL25304543 | 0.83 | PTK2 (0.66) | ALKPTK2INSRAURKAMET | |
| SCHEMBL19601638 | 0.82 | ALK (0.65) | ALKPTK2INSRAURKAMET | |
| SCHEMBL12570609 | 0.81 | ALK (0.67) | ALKPTK2INSRAURKAMET | |
| SCHEMBL12893063 | 0.81 | ALK (0.77) | ALKPTK2INSRAURKAMET | |
| SCHEMBL2592094 | 0.78 | ALK (0.67) | ALKPTK2INSRAURKAMET | |
| SCHEMBL10207667 | 0.78 | ALK (0.67) | ALKPTK2INSRAURKAMET | |
| SCHEMBL2595611 | 0.78 | EGFR (0.65) | ALKPTK2INSRAURKAMET | |
| SCHEMBL28384265 | 0.78 | ALK (0.76) | ALKPTK2INSRAURKAMET | |
| SCHEMBL21437921 | 0.78 | AXL (0.70) | ALKPTK2AURKAMAPK9MAPK10 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023134582-A1 | PYRIMIDINE-2,4-DIAMINE DERIVATIVES AS WELL AS PREPARATION METHOD THEREFOR AND USE THEREOF | 上海立森印迹医药技术有限公司 | 2023-07-20 | — | — | WO | disclosed |
| CN-116444488-A | Pyrimidine-2, 4-diamine derivative and preparation method and application thereof | 上海立森印迹医药技术有限公司 | 2023-07-18 | — | — | CN | disclosed |