Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | SMO | Q99835 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7589338 | 0.94 | AR (0.32) | AR | |
| SCHEMBL7572424 | 0.89 | AR (0.37) | ARCYP3A4HTTSMO | |
| SCHEMBL13054170 | 0.89 | AR (0.37) | ARCYP3A4HTTSMO | |
| SCHEMBL7582095 | 0.88 | MEN1 (0.31) | — | |
| SCHEMBL7583487 | 0.85 | ABCC9 (0.32) | — | |
| SCHEMBL7584231 | 0.84 | ELANE (0.33) | CYP3A4HTT | |
| SCHEMBL7580536 | 0.83 | NPY5R (0.34) | — | |
| SCHEMBL7583661 | 0.82 | PGR (0.31) | HTT | |
| SCHEMBL13054394 | 0.82 | AR (0.36) | AR | |
| SCHEMBL7551279 | 0.82 | AR (0.36) | AR |
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 |
|---|---|---|---|---|---|---|---|
| US-8183252-B2 | Heterocyclic aspartyl protease inhibitors | SCHERING CORPORATION (US) | 2012-05-22 | — | — | US | disclosed |