Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.38 |
| ▸ | RELA | Q04206 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1868493 | 0.82 | NPC1 (0.61) | PKMMEN1KMT2ANPC1RAB9A | |
| SCHEMBL13007609 | 0.80 | SCN3A (0.47) | PKMMEN1KMT2ASMN1; SMN2SCN3A | |
| SCHEMBL11959670 | 0.79 | NPC1 (0.50) | PKMMEN1KMT2ANPC1RAB9A | |
| SCHEMBL1860725 | 0.79 | NPC1 (0.52) | PKMMEN1KMT2ANPC1RAB9A | |
| SCHEMBL11959668 | 0.77 | NPC1 (0.49) | PKMMEN1KMT2ANPC1RAB9A | |
| SCHEMBL1858135 | 0.77 | KMT2A (0.57) | MEN1KMT2ASCN3A | |
| SCHEMBL13061291 | 0.76 | NPC1 (0.50) | PKMMEN1KMT2ANPC1RAB9A | |
| SCHEMBL11959667 | 0.75 | PKM (0.49) | PKMMEN1KMT2ANPC1RAB9A | |
| SCHEMBL11959666 | 0.75 | PKM (0.65) | PKMSCN3A | |
| SCHEMBL13007597 | 0.74 | USP30 (0.47) | PKMMEN1KMT2ASMN1; SMN2SCN3A |
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-2007030618-A2 | BICYCLIC DERIVATIVES AS MODULATORS OF VOLTAGE GATED ION CHANNELS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2007-03-15 | — | — | WO | disclosed |