Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IRAK4 | Q9NWZ3 | 12/20 | 0.41 |
| ▸ | CCR1 | P32246 | 8/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL19045902 | 0.85 | IRAK4 (0.55) | IRAK4 | |
| SCHEMBL19045886 | 0.84 | IRAK4 (0.36) | IRAK4 | |
| SCHEMBL19045959 | 0.78 | IRAK4 (0.36) | IRAK4CCR1 | |
| SCHEMBL19045150 | 0.76 | IRAK4 (0.36) | IRAK4CCR1 | |
| SCHEMBL19046092 | 0.74 | IRAK4 (0.34) | IRAK4 | |
| SCHEMBL19030453 | 0.73 | IRAK4 (0.40) | IRAK4 | |
| SCHEMBL19030740 | 0.72 | DRD2 (0.43) | IRAK4CCR1KCNH2 | |
| SCHEMBL19045317 | 0.70 | IRAK4 (0.57) | IRAK4 | |
| SCHEMBL19046139 | 0.69 | IRAK4 (0.36) | IRAK4 | |
| SCHEMBL19045148 | 0.68 | IRAK4 (0.37) | IRAK4 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2017108723-A2 | PYRAZOLO[1,5a]PYRIMIDINE DERIVATIVES AS IRAK4 MODULATORS | F. HOFFMANN-LA ROCHE AG (CH) | 2017-06-29 | — | — | WO | disclosed |