Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.40 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | GSK3A | P49840 | 3/20 | 0.38 |
| ▸ | GSK3B | P49841 | 3/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.38 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4253439 | 0.85 | ALDH1A1 (0.59) | ALDH1A1MAPTMEN1KMT2AHPGD | |
| SCHEMBL4258340 | 0.76 | BACE1 (0.35) | GAA | |
| SCHEMBL7273862 | 0.74 | ALDH1A1 (0.60) | ALDH1A1MAPTMEN1KMT2AHPGD | |
| SCHEMBL7266747 | 0.73 | KDM4E (0.56) | ALDH1A1MAPTMEN1KMT2AHPGD | |
| SCHEMBL7265874 | 0.72 | MAPT (0.46) | ALDH1A1MAPTMEN1KMT2AHPGD | |
| SCHEMBL10683747 | 0.72 | ALDH1A1 (0.44) | ALDH1A1MAPTMEN1KMT2AHPGD | |
| SCHEMBL9433907 | 0.71 | KDM4E (0.45) | ALDH1A1MAPTMEN1KMT2AHPGD | |
| SCHEMBL7815170 | 0.71 | ALDH1A1 (0.59) | ALDH1A1MAPTMEN1KMT2AHPGD | |
| SCHEMBL11752910 | 0.71 | ALDH1A1 (0.91) | ALDH1A1MAPTMEN1KMT2AHPGD | |
| SCHEMBL16460212 | 0.71 | GSK3B (0.71) | ALDH1A1MAPTKMT2AHPGDGAA |
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-2010002483-A1 | OPTIONALLY CONDENSED DIHYDRO PYRIDINE, DIHYDROPYRIMIDINE AND DIHYDRO PYRANE DERIVATIVES ACTING AS LATE SODIUM CHANNEL BLOCKERS | CV THERAPEUTICS, INC. (US) | 2010-01-07 | — | — | WO | disclosed |