Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CIT | O14578 | 1/20 | 0.47 |
| ▸ | CCNK | O75909 | 5/20 | 0.47 |
| ▸ | CDK12 | Q9NYV4 | 5/20 | 0.47 |
| ▸ | LRRK2 | Q5S007 | 3/20 | 0.47 |
| ▸ | PRKCI | P41743 | 2/20 | 0.46 |
| ▸ | NUDT1 | P36639 | 4/20 | 0.46 |
| ▸ | JAK2 | O60674 | 2/20 | 0.46 |
| ▸ | PRKACA | P17612 | 2/20 | 0.46 |
| ▸ | JAK3 | P52333 | 2/20 | 0.46 |
| ▸ | PRKCQ | Q04759 | 2/20 | 0.46 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.46 |
| ▸ | IGF1R | P08069 | 2/20 | 0.46 |
| ▸ | DYRK1B | Q9Y463 | 2/20 | 0.46 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.46 |
| ▸ | IKBKB | O14920 | 1/20 | 0.46 |
| ▸ | CHUK | O15111 | 1/20 | 0.46 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.46 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.46 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.46 |
| ▸ | PAK4 | O96013 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL12127576 | 0.84 | NUDT1 (0.52) | CITCCNKCDK12LRRK2PRKCI | |
| SCHEMBL10125124 | 0.81 | AURKB (0.51) | CITCCNKCDK12LRRK2PRKCI | |
| SCHEMBL10125110 | 0.80 | LRRK2 (0.58) | CITCCNKCDK12LRRK2PRKCI | |
| SCHEMBL12127929 | 0.80 | PRKCI (0.54) | CITCCNKCDK12LRRK2PRKCI | |
| SCHEMBL3576055 | 0.79 | CIT (0.53) | CITCCNKCDK12LRRK2PRKCI | |
| SCHEMBL2240671 | 0.75 | AURKB (0.71) | CITCCNKCDK12LRRK2PRKCI | |
| SCHEMBL78242 | 0.74 | LRRK2 (0.56) | CITLRRK2PRKCINUDT1JAK2 | |
| SCHEMBL4790144 | 0.73 | IKBKB (0.70) | CITCCNKCDK12LRRK2PRKCI | |
| SCHEMBL12127232 | 0.73 | NUDT1 (0.47) | CITCCNKCDK12LRRK2PRKCI | |
| SCHEMBL857132 | 0.72 | IKBKB (0.63) | CITCCNKCDK12LRRK2PRKCI |
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-2009094123-A1 | PROTEIN KINASE INHIBITORS AND USE THEREOF | MERCK SERONO S.A. (CH) | 2009-07-30 | — | — | WO | disclosed |