Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKB | Q96GD4 | 3/20 | 0.56 |
| ▸ | AURKA | O14965 | 2/20 | 0.56 |
| ▸ | INCENP | Q9NQS7 | 2/20 | 0.56 |
| ▸ | TPX2 | Q9ULW0 | 2/20 | 0.56 |
| ▸ | JAK2 | O60674 | 14/20 | 0.53 |
| ▸ | JAK1 | P23458 | 9/20 | 0.53 |
| ▸ | JAK3 | P52333 | 5/20 | 0.53 |
| ▸ | TYK2 | P29597 | 2/20 | 0.53 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.49 |
| ▸ | CCNK | O75909 | 2/20 | 0.44 |
| ▸ | CDK12 | Q9NYV4 | 2/20 | 0.44 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.43 |
| ▸ | IKBKB | O14920 | 1/20 | 0.42 |
| ▸ | CHUK | O15111 | 1/20 | 0.42 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.42 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.42 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.42 |
| ▸ | PAK4 | O96013 | 1/20 | 0.42 |
| ▸ | CSF1R | P07333 | 1/20 | 0.42 |
| ▸ | RET | P07949 | 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 | |
|---|---|---|---|---|
| SCHEMBL98899 | 0.83 | JAK2 (0.56) | AURKBAURKAJAK2JAK1JAK3 | |
| SCHEMBL99736 | 0.83 | AURKB (0.56) | AURKBAURKAINCENPTPX2JAK2 | |
| SCHEMBL21085376 | 0.82 | AURKB (0.63) | AURKBAURKAINCENPTPX2JAK2 | |
| SCHEMBL18602404 | 0.77 | AURKB (0.57) | AURKBAURKAINCENPTPX2JAK2 | |
| SCHEMBL99868 | 0.77 | AURKB (0.59) | AURKBAURKAINCENPTPX2JAK2 | |
| SCHEMBL19832104 | 0.77 | AURKB (0.48) | AURKBAURKAINCENPTPX2JAK2 | |
| SCHEMBL15389485 | 0.77 | AURKB (0.56) | AURKBAURKAINCENPTPX2JAK2 | |
| Trifluoroacetic Acid SCHEMBL99138 | 0.76 | JAK2 (0.48) | AURKBAURKAINCENPTPX2JAK2 | |
| Trifluoroacetic Acid SCHEMBL29541266 | 0.76 | JAK2 (0.48) | AURKBAURKAINCENPTPX2JAK2 | |
| SCHEMBL13541161 | 0.75 | AURKB (0.63) | AURKBAURKAINCENPTPX2JAK2 |
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-2017097224-A1 | AZETIDINE DERIVATIVE, PREPARATION METHOD THEREFOR, AND USE THEREOF | 四川科伦博泰生物医药股份有限公司 | 2017-06-15 | — | — | WO | disclosed |