Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BUB1 | O43683 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | BCHE | P06276 | 1/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.34 |
| ▸ | ABL1 | P00519 | 1/20 | 0.34 |
| ▸ | EGFR | P00533 | 1/20 | 0.34 |
| ▸ | HCK | P08631 | 1/20 | 0.34 |
| ▸ | SRC | P12931 | 1/20 | 0.34 |
| ▸ | KDR | P35968 | 1/20 | 0.34 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.34 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.34 |
| ▸ | MTOR | P42345 | 1/20 | 0.34 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.34 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.34 |
| ▸ | PRKDC | P78527 | 1/20 | 0.34 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.34 |
| ▸ | ENPP3 | O14638 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29128021 | 0.86 | BUB1 (0.39) | BUB1L3MBTL1BCHEHSP90AA1HSP90AB1 | |
| SCHEMBL25703228 | 0.84 | BUB1 (0.38) | BUB1L3MBTL1BCHEHSP90AA1HSP90AB1 | |
| SCHEMBL29522590 | 0.84 | PIK3CA (0.38) | BUB1L3MBTL1BCHEHSP90AA1HSP90AB1 | |
| SCHEMBL31240726 | 0.84 | ENPP3 (0.48) | BUB1L3MBTL1BCHEHSP90AA1HSP90AB1 | |
| SCHEMBL2792837 | 0.84 | HSP90AA1 (0.39) | BUB1L3MBTL1BCHEHSP90AA1HSP90AB1 | |
| SCHEMBL138212 | 0.84 | PIK3CA (0.38) | BUB1L3MBTL1BCHEHSP90AA1HSP90AB1 | |
| SCHEMBL580658 | 0.84 | ENPP3 (0.48) | BUB1L3MBTL1BCHEHSP90AA1HSP90AB1 | |
| SCHEMBL30991728 | 0.84 | BUB1 (0.38) | BUB1L3MBTL1BCHEHSP90AA1HSP90AB1 | |
| SCHEMBL18441417 | 0.83 | BUB1 (0.37) | BUB1BCHEHSP90AA1HSP90AB1POLB | |
| SCHEMBL1457357 | 0.81 | HSP90AA1 (0.37) | BUB1L3MBTL1BCHEHSP90AA1HSP90AB1 |
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-2022067106-A1 | CRYSTALLINE POLYMORPH FORM A OF A JAK INHIBITOR AND METHODS FOR ITS PREPARATION | ACLARIS THERAPEUTICS, INC. (US) | 2022-03-31 | — | — | WO | disclosed |