Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKT1 | P31749 | 16/20 | 0.66 |
| ▸ | RPS6KB1 | P23443 | 14/20 | 0.66 |
| ▸ | AURKB | Q96GD4 | 11/20 | 0.66 |
| ▸ | INCENP | Q9NQS7 | 10/20 | 0.66 |
| ▸ | AURKA | O14965 | 2/20 | 0.61 |
| ▸ | AKT2 | P31751 | 1/20 | 0.52 |
| ▸ | AKT3 | Q9Y243 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL17865832 | 0.93 | AKT1 (0.66) | AKT1RPS6KB1AURKBINCENPAURKA | |
| SCHEMBL17865864 | 0.92 | AKT1 (0.78) | AKT1RPS6KB1AURKBINCENPAURKA | |
| SCHEMBL17865813 | 0.92 | RPS6KB1 (0.75) | AKT1RPS6KB1AURKBINCENPAURKA | |
| SCHEMBL17865838 | 0.91 | RPS6KB1 (0.62) | AKT1RPS6KB1AURKBINCENPAURKA | |
| SCHEMBL17865840 | 0.91 | RPS6KB1 (0.66) | AKT1RPS6KB1AURKBINCENPAURKA | |
| SCHEMBL17865857 | 0.91 | AKT1 (0.68) | AKT1RPS6KB1AURKBINCENPAURKA | |
| SCHEMBL17865814 | 0.88 | AKT1 (0.65) | AKT1RPS6KB1AURKBINCENPAURKA | |
| SCHEMBL17865823 | 0.87 | AKT1 (0.77) | AKT1RPS6KB1AURKBINCENPAURKA | |
| SCHEMBL17865837 | 0.87 | AKT1 (0.63) | AKT1RPS6KB1AURKBINCENPAURKA | |
| SCHEMBL8514894 | 0.87 | RPS6KB1 (0.84) | AKT1RPS6KB1AURKBINCENPAURKA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2643313-B9 | QUINAZOLINE CARBOXAMIDE AZETIDINES | MERCK PATENT GMBH (DE) | 2017-02-22 | — | — | EP | claimed |
| EP-2643313-B1 | QUINAZOLINE CARBOXAMIDE AZETIDINES | MERCK PATENT GMBH (DE) | 2016-06-29 | — | — | EP | claimed |