Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5AP | P20292 | 15/20 | 0.36 |
| ▸ | FEN1 | P39748 | 14/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | SYK | P43405 | 1/20 | 0.36 |
| ▸ | ATR | Q13535 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL3397744 | 0.78 | NPC1 (0.41) | MAPK1CYP2D6SYKATRNPC1 | |
| SCHEMBL3396844 | 0.78 | NOS1 (0.40) | MAPK1CYP2D6SYKATRNPC1 | |
| SCHEMBL3398248 | 0.77 | MAPK1 (0.40) | MAPK1CYP2D6SYKNPC1 | |
| SCHEMBL2343779 | 0.77 | MAPK1 (0.36) | MAPK1CYP2D6SYK | |
| SCHEMBL3398594 | 0.77 | MAPK1 (0.38) | MAPK1CYP2D6SYK | |
| SCHEMBL3396277 | 0.76 | JAK3 (0.39) | MAPK1CYP2D6SYKNPC1 | |
| SCHEMBL3396888 | 0.76 | MAPK1 (0.37) | MAPK1CYP2D6SYKATR | |
| SCHEMBL3398889 | 0.76 | SYK (0.44) | SYK | |
| SCHEMBL3397717 | 0.75 | MAPK1 (0.41) | MAPK1 | |
| SCHEMBL3395483 | 0.75 | MAPK1 (0.47) | MAPK1 |
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-2245033-A1 | PYRROLOPYRAZINE KINASE INHIBITORS | F. Hoffmann-La Roche AG (CH) | 2010-11-03 | — | — | EP | claimed |
| WO-2009106441-A1 | PYRROLOPYRAZINE KINASE INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2009-09-03 | — | — | WO | claimed |