Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 18/20 | 0.76 |
| ▸ | RPS6KB1 | P23443 | 17/20 | 0.76 |
| ▸ | AURKB | Q96GD4 | 9/20 | 0.56 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL665444 | 0.86 | AURKA (1.00) | AURKARPS6KB1AURKBPDPK1 | |
| SCHEMBL28011761 | 0.82 | AURKA (0.76) | AURKARPS6KB1AURKB | |
| SCHEMBL27830081 | 0.80 | AURKA (0.75) | AURKARPS6KB1AURKBPDPK1 | |
| SCHEMBL27830110 | 0.79 | AURKA (0.74) | AURKARPS6KB1AURKB | |
| SCHEMBL666498 | 0.78 | RPS6KB1 (0.85) | AURKARPS6KB1AURKBPDPK1 | |
| SCHEMBL27830109 | 0.78 | RPS6KB1 (0.75) | AURKARPS6KB1AURKBPDPK1 | |
| SCHEMBL27848547 | 0.77 | AURKA (0.75) | AURKARPS6KB1AURKB | |
| SCHEMBL28011763 | 0.76 | GALR3 (0.47) | AURKARPS6KB1AURKB | |
| SCHEMBL27830100 | 0.74 | AURKA (0.73) | AURKARPS6KB1AURKB | |
| SCHEMBL27830098 | 0.74 | AURKA (0.73) | AURKARPS6KB1AURKB |
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 |
|---|---|---|---|---|---|---|---|
| CN-102317269-A | Novel amino aza heterocyclic carboxamides | MERCK PATENT GMBH | 2012-01-11 | — | — | CN | disclosed |