Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IRAK4 | Q9NWZ3 | 6/20 | 0.61 |
| ▸ | JAK2 | O60674 | 13/20 | 0.59 |
| ▸ | TYK2 | P29597 | 7/20 | 0.56 |
| ▸ | JAK1 | P23458 | 6/20 | 0.56 |
| ▸ | JAK3 | P52333 | 6/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.56 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.52 |
| ▸ | FYN | P06241 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | ROS1 | P08922 | 1/20 | 0.52 |
| ▸ | NTRK3 | Q16288 | 1/20 | 0.52 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL22640556 | 0.87 | IRAK4 (0.62) | IRAK4JAK2TYK2JAK1JAK3 | |
| SCHEMBL22640619 | 0.86 | JAK2 (0.60) | IRAK4JAK2TYK2JAK1JAK3 | |
| SCHEMBL22640727 | 0.85 | EPHB3 (0.62) | IRAK4JAK2TYK2JAK1JAK3 | |
| SCHEMBL22640661 | 0.82 | EPHB3 (0.65) | IRAK4JAK2TYK2JAK1JAK3 | |
| SCHEMBL22640657 | 0.82 | IRAK4 (0.63) | IRAK4JAK2TYK2JAK1JAK3 | |
| SCHEMBL22640574 | 0.82 | IRAK4 (0.63) | IRAK4JAK2TYK2JAK1JAK3 | |
| SCHEMBL22640577 | 0.82 | EPHB3 (0.66) | IRAK4JAK2TYK2JAK1JAK3 | |
| SCHEMBL403850 | 0.79 | JAK2 (0.83) | IRAK4JAK2TYK2JAK1JAK3 | |
| SCHEMBL22640729 | 0.79 | IRAK4 (0.62) | IRAK4JAK2TYK2JAK1JAK3 | |
| SCHEMBL22640700 | 0.78 | IRAK4 (0.63) | IRAK4JAK2TYK2JAK1JAK3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3267996-B1 | PYRAZOLOPYRIMIDINE INHIBITORS OF IRAK4 ACTIVITY | MERCK SHARP & DOHME (US) | 2020-11-11 | — | — | EP | disclosed |