Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 9/20 | 0.49 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.39 |
| ▸ | CLK1 | P49759 | 1/20 | 0.38 |
| ▸ | CLK2 | P49760 | 1/20 | 0.38 |
| ▸ | CLK3 | P49761 | 1/20 | 0.38 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.38 |
| ▸ | HIPK1 | Q86Z02 | 1/20 | 0.38 |
| ▸ | HIPK2 | Q9H2X6 | 1/20 | 0.38 |
| ▸ | HIPK3 | Q9H422 | 1/20 | 0.38 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.38 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.38 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.38 |
| ▸ | CD74 | P04233 | 1/20 | 0.38 |
| ▸ | MIF | P14174 | 1/20 | 0.38 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | SYK | P43405 | 1/20 | 0.36 |
| ▸ | EGFR | P00533 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3396005 | 0.84 | SCN9A (0.42) | MAPK1CYP2E1CYP2A6CYP2B6CYP2D6 | |
| SCHEMBL2280067 | 0.79 | JAK3 (0.56) | MAPK1CD74MIFCYP2D6SYK | |
| SCHEMBL3399095 | 0.78 | CDK8 (0.42) | MAPK1CLK1DYRK1ACYP2D6SYK | |
| SCHEMBL3396270 | 0.77 | CDK8 (0.48) | MAPK1CLK1DYRK1ACYP2D6SYK | |
| SCHEMBL3393845 | 0.77 | MAPK1 (0.38) | MAPK1CLK1DYRK1ACYP2D6SYK | |
| SCHEMBL3396373 | 0.74 | JAK3 (0.44) | MAPK1JAK3 | |
| SCHEMBL3397956 | 0.73 | MAPK1 (0.42) | MAPK1CYP2D6 | |
| SCHEMBL3394716 | 0.72 | CYP2D6 (0.35) | MAPK1CYP2D6SYKJAK3 | |
| SCHEMBL2337979 | 0.72 | MAPK1 (0.37) | MAPK1PDPK1CLK2DYRK1ACLK4 | |
| SCHEMBL2341240 | 0.71 | LRRK2 (0.38) | MAPK1SYKJAK3 |
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 |