Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SYK | P43405 | 15/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.35 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.35 |
| ▸ | CDC42BPA | Q5VT25 | 2/20 | 0.35 |
| ▸ | CDC42BPB | Q9Y5S2 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.33 |
| ▸ | KLK1 | P06870 | 1/20 | 0.33 |
| ▸ | JAK3 | P52333 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2345790 | 0.90 | ROCK2 (0.37) | SYKROCK2ROCK1CDC42BPACDC42BPB | |
| SCHEMBL3399528 | 0.83 | LRRK2 (0.39) | SYKMAPK1KLKB1KLK1JAK3 | |
| SCHEMBL3397988 | 0.83 | LRRK2 (0.39) | SYKMAPK1KLKB1KLK1JAK3 | |
| SCHEMBL3399555 | 0.82 | ITGB2 (0.39) | ROCK2ROCK1CDC42BPBMAPK1KLKB1 | |
| SCHEMBL3401949 | 0.82 | MAPK1 (0.35) | MAPK1JAK3 | |
| SCHEMBL3397858 | 0.81 | HRH4 (0.42) | ROCK2ROCK1CDC42BPACDC42BPBKLKB1 | |
| SCHEMBL1887679 | 0.80 | JAK3 (0.47) | SYKJAK3 | |
| SCHEMBL3398822 | 0.80 | ITGB2 (0.39) | JAK3 | |
| SCHEMBL3401928 | 0.79 | MAP3K12 (0.34) | MAPK1KLKB1KLK1JAK3 | |
| SCHEMBL3397717 | 0.78 | MAPK1 (0.41) | MAPK1JAK3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2247592-A1 | PYRROLOPYRAZINE KINASE INHIBITORS | F. Hoffmann-La Roche AG (CH) | 2010-11-10 | — | — | EP | claimed |
| WO-2009106442-A1 | PYRROLOPYRAZINE KINASE INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2009-09-03 | — | — | WO | claimed |
| EP-2247592-A1 | PYRROLOPYRAZINE KINASE INHIBITORS | F. Hoffmann-La Roche AG (CH) | 2010-11-10 | — | — | EP | disclosed |
| WO-2009106442-A1 | PYRROLOPYRAZINE KINASE INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2009-09-03 | — | — | WO | disclosed |