Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 3/20 | 0.35 |
| ▸ | CACNA1B | Q00975 | 2/20 | 0.31 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL3001034 | 0.87 | KDM4E (0.39) | GAA | |
| SCHEMBL3246994 | 0.76 | ALDH1A1 (0.47) | GAA | |
| SCHEMBL3241029 | 0.66 | KDM4E (0.39) | BACE1CACNA1B | |
| SCHEMBL4253439 | 0.62 | ALDH1A1 (0.59) | GAA | |
| SCHEMBL7278444 | 0.60 | CACNA1F (0.39) | CACNA1B | |
| SCHEMBL7279849 | 0.60 | CACNA1F (0.39) | CACNA1B | |
| SCHEMBL10721351 | 0.57 | DYRK1A (0.34) | BACE1CACNA1BGAA | |
| SCHEMBL10375741 | 0.57 | KDM4E (0.38) | BACE1CACNA1B | |
| SCHEMBL128971 | 0.57 | — | — | |
| SCHEMBL7410687 | 0.56 | CACNA1B (0.61) | CACNA1BGAA |
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-2009006580-A1 | OPTIONALLY CONDENSED DIHYDROPYRIDINE, DIHYDROPYRIMIDINE AND DIHYDROPYRANE DERIVATIVES ACTING AS LATE SODIUM CHANNEL BLOCKERS | CV THERAPEUTICS, INC. (US) | 2009-01-08 | — | — | WO | disclosed |