Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK3 | P52333 | 12/20 | 0.50 |
| ▸ | SYK | P43405 | 8/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3401913 | 0.87 | JAK3 (0.45) | JAK3SYKKCNH2CYP2C9 | |
| SCHEMBL2274945 | 0.87 | JAK3 (0.51) | JAK3SYKKCNH2CYP2C9CYP2D6 | |
| SCHEMBL2278520 | 0.82 | JAK3 (0.55) | JAK3SYKKCNH2CYP2C9CYP2D6 | |
| SCHEMBL2278709 | 0.82 | JAK3 (0.55) | JAK3SYKKCNH2CYP2C9CYP2D6 | |
| SCHEMBL3399667 | 0.81 | JAK3 (0.49) | JAK3SYKKCNH2CYP2D6 | |
| SCHEMBL2281125 | 0.81 | JAK3 (0.54) | JAK3SYKKCNH2CYP2C9CYP2D6 | |
| SCHEMBL2273575 | 0.80 | JAK3 (0.54) | JAK3SYKKCNH2 | |
| SCHEMBL2281784 | 0.80 | JAK3 (0.57) | JAK3SYKCYP2C9CYP2D6 | |
| SCHEMBL2275402 | 0.79 | JAK3 (0.53) | JAK3SYKKCNH2CYP2C9 | |
| SCHEMBL2279622 | 0.79 | JAK3 (0.55) | JAK3SYKKCNH2CYP2D6 |
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 |