Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.56 |
| ▸ | PPARD | Q03181 | 14/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL13335925 | 0.84 | POLB (0.40) | POLBPPARDALDH1A1KMT2A | |
| SCHEMBL3126218 | 0.81 | POLB (0.52) | POLBPPARDALDH1A1PKMKMT2A | |
| SCHEMBL23657811 | 0.80 | ALDH1A1 (0.50) | POLBPPARDALDH1A1PKMKMT2A | |
| SCHEMBL28654691 | 0.79 | POLB (0.49) | POLBPPARDALDH1A1KMT2A | |
| SCHEMBL3702320 | 0.78 | POLB (0.51) | POLBPPARDKMT2A | |
| SCHEMBL1300785 | 0.78 | POLB (0.48) | POLBPPARDALDH1A1KMT2A | |
| SCHEMBL2702353 | 0.78 | CA1 (0.55) | POLBPPARDALDH1A1PKMKMT2A | |
| SCHEMBL12412755 | 0.78 | POLB (0.48) | POLBPPARDALDH1A1KMT2A | |
| SCHEMBL9117847 | 0.77 | POLB (0.40) | POLBPPARD | |
| SCHEMBL9118202 | 0.77 | PPARD (0.39) | POLBPPARD |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2205083-A1 | SUBSTITUTED ARYL SULFONE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS | Merck Sharp & Dohme Corp. (US) | 2010-07-14 | — | — | EP | claimed |
| WO-2009045382-A1 | SUBSTITUTED ARYL SULFONE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS | MERCK & CO., INC. (US) | 2009-04-09 | — | — | WO | claimed |