Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 12/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.32 |
| ▸ | TACR1 | P25103 | 1/20 | 0.32 |
| ▸ | BACE1 | P56817 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL7581190 | 0.93 | BACE1 (0.31) | BACE1 | |
| SCHEMBL7582050 | 0.91 | — | — | |
| SCHEMBL7582435 | 0.90 | BACE1 (0.34) | BACE1 | |
| SCHEMBL7581043 | 0.90 | BACE1 (0.31) | BACE1 | |
| SCHEMBL7576890 | 0.89 | ELANE (0.37) | ELANECYP3A4HTTTRPM8L3MBTL1 | |
| SCHEMBL13054625 | 0.89 | ELANE (0.37) | ELANECYP3A4HTTTRPM8L3MBTL1 | |
| SCHEMBL7581886 | 0.88 | KDM1A (0.34) | HTT | |
| SCHEMBL7584854 | 0.88 | BACE1 (0.30) | BACE1 | |
| SCHEMBL7583661 | 0.87 | PGR (0.31) | HTTTACR1 | |
| SCHEMBL7588393 | 0.86 | P2RX7 (0.34) | TACR1 |
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 |