Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 15/20 | 0.43 |
| ▸ | AURKB | Q96GD4 | 14/20 | 0.43 |
| ▸ | NTRK1 | P04629 | 3/20 | 0.38 |
| ▸ | PLK4 | O00444 | 2/20 | 0.38 |
| ▸ | NTRK3 | Q16288 | 1/20 | 0.37 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.37 |
| ▸ | PAK4 | O96013 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL24743027 | 0.85 | AURKA (0.43) | AURKAAURKBNTRK1PLK4NTRK3 | |
| SCHEMBL24742505 | 0.79 | CYP3A4 (0.40) | AURKAAURKBNTRK1PLK4NTRK3 | |
| SCHEMBL24742500 | 0.79 | IGF1R (0.37) | AURKAAURKBNTRK3NTRK2PAK4 | |
| SCHEMBL24742498 | 0.74 | AURKA (0.41) | AURKAAURKB | |
| SCHEMBL24743061 | 0.72 | AURKA (0.42) | AURKAAURKBNTRK1PLK4NTRK3 | |
| SCHEMBL24743112 | 0.72 | RET (0.40) | AURKAAURKBNTRK1PLK4PAK4 | |
| SCHEMBL24742021 | 0.72 | AURKA (0.37) | AURKAAURKBNTRK1NTRK3NTRK2 | |
| SCHEMBL24742487 | 0.70 | RET (0.39) | AURKAAURKBNTRK1PLK4PAK4 | |
| SCHEMBL24741941 | 0.69 | PLK4 (0.39) | AURKAAURKBNTRK1PLK4PAK4 | |
| SCHEMBL24742552 | 0.68 | RET (0.41) | AURKAAURKB |
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-2022206888-A1 | CDK2 INHIBITORS AND USE THEREOF | QILU REGOR THERAPEUTICS INC. (CN) | 2022-10-06 | — | — | WO | disclosed |