Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IRAK4 | Q9NWZ3 | 19/20 | 0.52 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | FLT3 | P36888 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL25872158 | 0.86 | IRAK4 (0.53) | IRAK4HRH3FLT3 | |
| SCHEMBL25876713 | 0.80 | IRAK4 (0.62) | IRAK4 | |
| SCHEMBL25872020 | 0.80 | IRAK4 (0.56) | IRAK4FLT3 | |
| SCHEMBL25872021 | 0.79 | IRAK4 (0.56) | IRAK4FLT3 | |
| SCHEMBL25872156 | 0.77 | CA12 (0.36) | HRH3 | |
| SCHEMBL25871547 | 0.76 | CRBN (0.57) | IRAK4 | |
| SCHEMBL25872155 | 0.75 | BCHE (0.34) | HRH3 | |
| SCHEMBL25870256 | 0.74 | IRAK4 (0.55) | IRAK4 | |
| SCHEMBL25872902 | 0.74 | IRAK4 (0.56) | IRAK4FLT3 | |
| SCHEMBL25872904 | 0.74 | IRAK4 (0.56) | IRAK4FLT3 |
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-2023116920-A1 | PENTA- FUSED HEXA-HETEROCYCLIC COMPOUND, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USE | 杭州多域生物技术有限公司 | 2023-06-29 | — | — | WO | disclosed |