Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | STK3 | Q13188 | 6/20 | 0.44 |
| ▸ | CDC7 | O00311 | 2/20 | 0.44 |
| ▸ | MARK3 | P27448 | 2/20 | 0.44 |
| ▸ | PAK4 | O96013 | 2/20 | 0.44 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.44 |
| ▸ | PRKACA | P17612 | 2/20 | 0.44 |
| ▸ | GSK3A | P49840 | 2/20 | 0.44 |
| ▸ | GSK3B | P49841 | 2/20 | 0.44 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.44 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.44 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.44 |
| ▸ | NTRK2 | Q16620 | 2/20 | 0.44 |
| ▸ | PLK4 | O00444 | 1/20 | 0.44 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.44 |
| ▸ | AURKA | O14965 | 1/20 | 0.44 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.44 |
| ▸ | JAK2 | O60674 | 1/20 | 0.44 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.44 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.44 |
| ▸ | EGFR | P00533 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL22689966 | 0.82 | LRRK2 (0.36) | STK3CDC7MARK3PAK4NTRK1 | |
| SCHEMBL28520194 | 0.69 | CHUK (0.65) | PAK4NTRK1PRKACAGSK3AGSK3B | |
| SCHEMBL13539589 | 0.69 | CHUK (0.50) | STK3CDC7MARK3PAK4NTRK1 | |
| SCHEMBL22609952 | 0.68 | CHUK (0.49) | STK3CDC7MARK3PAK4NTRK1 | |
| SCHEMBL4252639 | 0.67 | LRRK2 (0.43) | STK3CDC7MARK3PAK4NTRK1 | |
| SCHEMBL29729934 | 0.67 | DHFR (0.44) | LCKFYNKDRRPS6KA3 | |
| SCHEMBL29730026 | 0.67 | DHFR (0.42) | MAPK1 | |
| SCHEMBL29729614 | 0.65 | ROCK1 (0.44) | CDC7PRKACAROCK1AURKACDK2 | |
| SCHEMBL4258084 | 0.63 | LRRK2 (0.47) | STK3CDC7MARK3PAK4NTRK1 | |
| SCHEMBL29730047 | 0.63 | ABL1 (0.40) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3971190-A1 | HETEROCYCLE-FUSED PYRIMIDINE DERIVATIVE AND USE THEREOF | Voronoi Inc. (KR) | 2022-03-23 | — | — | EP | disclosed |