Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK8 | P49336 | 3/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 9/20 | 0.40 |
| ▸ | SYK | P43405 | 3/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | JAK3 | P52333 | 3/20 | 0.36 |
| ▸ | CLK1 | P49759 | 1/20 | 0.34 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.34 |
| ▸ | BTK | Q06187 | 1/20 | 0.34 |
| ▸ | ITK | Q08881 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3396270 | 0.94 | CDK8 (0.48) | CDK8MAPK1SYKCYP2D6JAK3 | |
| SCHEMBL3393845 | 0.82 | MAPK1 (0.38) | CDK8MAPK1SYKCYP2D6JAK3 | |
| SCHEMBL2348644 | 0.82 | JAK3 (0.55) | CDK8MAPK1SYKCYP2D6JAK3 | |
| SCHEMBL2279878 | 0.82 | JAK3 (0.55) | CDK8MAPK1SYKCYP2D6JAK3 | |
| SCHEMBL3398976 | 0.78 | MAPK1 (0.49) | MAPK1SYKCYP2D6JAK3CLK1 | |
| SCHEMBL3396005 | 0.77 | SCN9A (0.42) | MAPK1SYKCYP2D6JAK3 | |
| SCHEMBL3396695 | 0.75 | PARP1 (0.39) | CDK8MAPK1SYKCYP2D6JAK3 | |
| SCHEMBL3394532 | 0.75 | JAK3 (0.35) | MAPK1SYKCYP2D6JAK3BTK | |
| SCHEMBL2277530 | 0.75 | JAK3 (0.57) | CDK8MAPK1SYKCYP2D6JAK3 | |
| SCHEMBL3396373 | 0.73 | JAK3 (0.44) | MAPK1JAK3BTKITK |
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 |