Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IRAK4 | Q9NWZ3 | 17/20 | 0.39 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.33 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL25959445 | 0.79 | CHEK1 (0.34) | CHEK1 | |
| SCHEMBL25958325 | 0.78 | TNF (0.34) | IRAK4CHEK1AR | |
| SCHEMBL25959914 | 0.76 | IRAK4 (0.36) | IRAK4 | |
| SCHEMBL25959425 | 0.75 | CHEK1 (0.34) | IRAK4CHEK1AR | |
| SCHEMBL25960805 | 0.68 | IRAK4 (0.34) | IRAK4 | |
| SCHEMBL25958323 | 0.68 | EGLN2 (0.33) | CHEK1 | |
| SCHEMBL25960484 | 0.68 | KMT2A (0.36) | IRAK4 | |
| SCHEMBL25960670 | 0.68 | IRAK4 (0.36) | IRAK4 | |
| SCHEMBL25959188 | 0.60 | — | — | |
| SCHEMBL25961330 | 0.59 | SYK (0.35) | 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 |
|---|---|---|---|---|---|---|---|
| EP-3870582-B1 | 5-AZAINDAZOLE DERIVATIVES AS ADENOSINE RECEPTOR ANTAGONISTS | MERCK PATENT GMBH (DE) | 2023-07-19 | — | — | EP | disclosed |