Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | UTS2R | Q9UKP6 | 1/20 | 0.33 |
| ▸ | HTR7 | P34969 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL356876 | 0.84 | IRAK1 (0.35) | — | |
| SCHEMBL358676 | 0.74 | ALOX5 (0.43) | ACHE | |
| SCHEMBL358732 | 0.74 | CXCR4 (0.41) | — | |
| SCHEMBL358705 | 0.74 | L3MBTL1 (0.50) | ALDH1A1DRD2 | |
| SCHEMBL364015 | 0.72 | PTPN11 (0.37) | ALDH1A1 | |
| SCHEMBL363125 | 0.72 | TYMP (0.40) | ACHE | |
| SCHEMBL12225935 | 0.72 | PTGIR (0.43) | — | |
| SCHEMBL359605 | 0.70 | BPTF (0.43) | ALDH1A1 | |
| SCHEMBL358287 | 0.70 | ALOX5 (0.39) | — | |
| SCHEMBL363723 | 0.68 | TYMP (0.36) | ALDH1A1ACHE |
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-3252054-A1 | PYRAZOLO[1,5A]PYRIMIDINE DERIVATIVES AS IRAK4 MODULATORS | F. Hoffmann-La Roche AG (CH) | 2017-12-06 | — | — | EP | disclosed |