Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 12/20 | 0.54 |
| ▸ | AURKB | Q96GD4 | 8/20 | 0.51 |
| ▸ | BRD4 | O60885 | 4/20 | 0.46 |
| ▸ | ATAD2 | Q6PL18 | 4/20 | 0.46 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.46 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.46 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.46 |
| ▸ | RET | P07949 | 1/20 | 0.46 |
| ▸ | HCK | P08631 | 1/20 | 0.46 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.46 |
| ▸ | FLT4 | P35916 | 1/20 | 0.46 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.46 |
| ▸ | SIK1 | P57059 | 1/20 | 0.46 |
| ▸ | TNK2 | Q07912 | 1/20 | 0.46 |
| ▸ | WNK3 | Q9BYP7 | 1/20 | 0.46 |
| ▸ | PARP1 | P09874 | 1/20 | 0.43 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.43 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.43 |
| ▸ | CDC42BPB | Q9Y5S2 | 3/20 | 0.43 |
| ▸ | UTS2R | Q9UKP6 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6522692 | 0.93 | AURKA (0.56) | AURKAAURKBBRD4ATAD2MAPK13 | |
| SCHEMBL4969185 | 0.77 | MKNK1 (0.48) | CHEK2 | |
| SCHEMBL29862882 | 0.77 | MKNK1 (0.48) | CHEK2 | |
| SCHEMBL900098 | 0.77 | MKNK1 (0.48) | CHEK2 | |
| Hydrochloric Acid SCHEMBL23360250 | 0.76 | MKNK1 (0.47) | CHEK2 | |
| Hydrochloric Acid SCHEMBL29862477 | 0.76 | MKNK1 (0.47) | CHEK2 | |
| Hydrochloric Acid SCHEMBL23360261 | 0.76 | MKNK1 (0.47) | CHEK2 | |
| Hydrochloric Acid SCHEMBL29862725 | 0.76 | MKNK1 (0.47) | CHEK2 | |
| Hydrochloric Acid SCHEMBL23360251 | 0.76 | MKNK1 (0.47) | CHEK2 | |
| Hydrochloric Acid SCHEMBL29862720 | 0.76 | MKNK1 (0.47) | CHEK2 |
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-2254889-B1 | PROTEIN KINASE INHIBITORS AND USE THEREOF | MERCK PATENT GMBH (DE) | 2012-12-19 | — | — | EP | disclosed |
| WO-2009108670-A1 | PROTEIN KINASE INHIBITORS AND USE THEREOF | MERCK SERONO S.A. (CH) | 2009-09-03 | — | — | WO | disclosed |