Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 5/20 | 0.46 |
| ▸ | CDK1 | P06493 | 4/20 | 0.46 |
| ▸ | CDK9 | P50750 | 3/20 | 0.46 |
| ▸ | IKBKB | O14920 | 2/20 | 0.41 |
| ▸ | SYK | P43405 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 5/20 | 0.41 |
| ▸ | CA1 | P00915 | 4/20 | 0.41 |
| ▸ | CA9 | Q16790 | 4/20 | 0.41 |
| ▸ | CA4 | P22748 | 3/20 | 0.41 |
| ▸ | PTK2 | Q05397 | 2/20 | 0.41 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.40 |
| ▸ | CDK7 | P50613 | 2/20 | 0.40 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.40 |
| ▸ | CCNH | P51946 | 1/20 | 0.40 |
| ▸ | STK4 | Q13043 | 3/20 | 0.40 |
| ▸ | PLK1 | P53350 | 1/20 | 0.40 |
| ▸ | PLK3 | Q9H4B4 | 1/20 | 0.40 |
| ▸ | PLK2 | Q9NYY3 | 1/20 | 0.40 |
| ▸ | CCNE1 | P24864 | 3/20 | 0.40 |
| ▸ | CDK4 | P11802 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1632502 | 0.80 | ALDH1A1 (0.46) | CDK2CDK1CDK9IKBKBSYK | |
| SCHEMBL1632150 | 0.79 | CA2 (0.52) | CDK2CDK1CDK9IKBKBCA2 | |
| SCHEMBL1632121 | 0.78 | SYK (0.45) | CDK2CDK1CDK9IKBKBSYK | |
| SCHEMBL1633856 | 0.78 | PTK2 (0.48) | CDK2CDK1CDK9IKBKBSYK | |
| Hydrochloric Acid SCHEMBL16445902 | 0.76 | CDK2 (0.47) | CDK2CDK1CDK9IKBKBSYK | |
| SCHEMBL1632900 | 0.76 | BRAF (0.46) | CDK2CDK1CDK9IKBKBCA2 | |
| SCHEMBL1634500 | 0.76 | SYK (0.49) | CDK2CDK1CDK9IKBKBSYK | |
| SCHEMBL1632328 | 0.75 | CA2 (0.50) | CDK2CDK1CDK9IKBKBCA2 | |
| SCHEMBL1633514 | 0.74 | CDK1 (0.44) | CDK2CDK1CDK9IKBKBCA2 | |
| SCHEMBL1633356 | 0.74 | CDK1 (0.44) | CDK2CDK1CDK9IKBKBCA2 |
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 |
|---|---|---|---|---|---|---|---|
| US-7932262-B2 | Quinazolines for PDK1 inhibition | NOVARTIS AG (CH) | 2011-04-26 | — | — | US | disclosed |