Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 1/20 | 0.43 |
| ▸ | CNR2 | P34972 | 6/20 | 0.42 |
| ▸ | CNR1 | P21554 | 3/20 | 0.42 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.42 |
| ▸ | KIT | P10721 | 1/20 | 0.42 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.42 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.41 |
| ▸ | JAK2 | O60674 | 3/20 | 0.41 |
| ▸ | JAK1 | P23458 | 3/20 | 0.41 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | TYK2 | P29597 | 2/20 | 0.41 |
| ▸ | JAK3 | P52333 | 2/20 | 0.41 |
| ▸ | PARP1 | P09874 | 1/20 | 0.40 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.40 |
| ▸ | MTOR | P42345 | 1/20 | 0.40 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.39 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.39 |
| ▸ | FGFR2 | P21802 | 1/20 | 0.39 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3393721 | 0.84 | PIK3CD (0.41) | CHEK1CNR2CNR1PIK3CDKIT | |
| SCHEMBL2280862 | 0.81 | PARP1 (0.46) | CHEK1CNR2CNR1PIK3CDKIT | |
| SCHEMBL3399527 | 0.76 | CNR2 (0.38) | CHEK1CNR2CNR1MAP4K4TLR7 | |
| SCHEMBL3396467 | 0.76 | CNR2 (0.39) | CHEK1CNR2CNR1MAP4K4TLR7 | |
| SCHEMBL3399133 | 0.75 | TNIK (0.43) | KITTLR7PARP1 | |
| SCHEMBL2277420 | 0.72 | JAK3 (0.53) | CNR2JAK2JAK3PARP1 | |
| SCHEMBL3398118 | 0.72 | MAP4K4 (0.39) | CNR2CNR1MAP4K4JAK2JAK3 | |
| SCHEMBL3391981 | 0.72 | JAK3 (0.36) | CNR2CNR1KITJAK2JAK1 | |
| SCHEMBL3396270 | 0.72 | CDK8 (0.48) | MAP4K4MAPK1JAK3 | |
| SCHEMBL2280094 | 0.72 | JAK3 (0.52) | CNR2CNR1JAK3PARP1 |
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 | disclosed |
| WO-2009106441-A1 | PYRROLOPYRAZINE KINASE INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2009-09-03 | — | — | WO | disclosed |