Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 1/20 | 0.35 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.35 |
| ▸ | PRKCI | P41743 | 2/20 | 0.34 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.31 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.31 |
| ▸ | PRKCA | P17252 | 1/20 | 0.31 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.31 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.31 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.31 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.31 |
| ▸ | AURKA | O14965 | 2/20 | 0.31 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.31 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.31 |
| ▸ | CDK4 | P11802 | 1/20 | 0.31 |
| ▸ | CCND1 | P24385 | 1/20 | 0.31 |
| ▸ | CDK9 | P50750 | 1/20 | 0.31 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.31 |
| ▸ | CDK11A | Q9UQ88 | 1/20 | 0.31 |
| ▸ | PARP1 | P09874 | 1/20 | 0.30 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL111098 | 0.78 | CDK4 (0.40) | ROCK2ROCK1PRKCIHRH4HRH3 | |
| SCHEMBL113063 | 0.74 | CDK4 (0.42) | ROCK2ROCK1AURKACDK4CCND1 | |
| SCHEMBL112120 | 0.67 | CDK4 (0.55) | HRH4HRH3CDK4CCND1CDK6 | |
| SCHEMBL111515 | 0.67 | CDK4 (0.57) | HRH3CDK4CCND1CDK6PARP1 | |
| SCHEMBL13076251 | 0.66 | CDK4 (0.48) | CDK4CCND1CDK6PARP1 | |
| SCHEMBL111309 | 0.65 | CDK4 (0.61) | CDK4CCND1CDK6PARP1 | |
| SCHEMBL2127303 | 0.64 | CDK4 (0.47) | HRH3AURKARIPK1CDK4CCND1 | |
| SCHEMBL13075590 | 0.62 | PRKCQ (0.37) | HRH4HRH3PRKCAPRKCQPRKCD | |
| SCHEMBL111484 | 0.61 | CDK4 (0.62) | CDK4CCND1CDK6IRAK4 | |
| SCHEMBL5205369 | 0.60 | PRKCA (0.46) | HRH4HRH3PRKCAPRKCQPRKCD |
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-2010125402-A1 | IMIDAZOLE DERIVATIVES AND THEIR USE AS MODULATORS OF CYCLIN DEPENDENT KINASES | NOVARTIS AG (CH) | 2010-11-04 | — | — | WO | disclosed |