Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.61 |
| ▸ | RAB9A | P51151 | 5/20 | 0.61 |
| ▸ | DEGS1 | O15121 | 3/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.57 |
| ▸ | TP53 | P04637 | 2/20 | 0.56 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | PKM | P14618 | 1/20 | 0.56 |
| ▸ | ABL1 | P00519 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | PTBP1 | P26599 | 1/20 | 0.53 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL30321414 | 0.93 | DEGS1 (0.57) | NPC1RAB9ADEGS1ALDH1A1TP53 | |
| SCHEMBL29127158 | 0.93 | DEGS1 (0.57) | NPC1RAB9ADEGS1ALDH1A1TP53 | |
| SCHEMBL24932376 | 0.82 | NPY5R (0.76) | NPC1RAB9AABL1NPY5R | |
| SCHEMBL24932289 | 0.80 | KDM4E (0.47) | NPC1RAB9ADEGS1SMN1; SMN2KMT2A | |
| SCHEMBL14563989 | 0.79 | GSK3B (0.49) | NPC1RAB9ADEGS1 | |
| SCHEMBL13681825 | 0.79 | GSK3B (0.49) | NPC1RAB9ADEGS1 | |
| SCHEMBL13678864 | 0.79 | DEGS1 (0.66) | NPC1RAB9ADEGS1ALDH1A1TP53 | |
| SCHEMBL29706156 | 0.79 | ABL1 (0.64) | NPC1RAB9ADEGS1ALDH1A1TP53 | |
| SCHEMBL29874618 | 0.79 | NPC1 (0.54) | NPC1RAB9ADEGS1ALDH1A1TP53 | |
| SCHEMBL28847350 | 0.79 | NPC1 (0.54) | NPC1RAB9ADEGS1ALDH1A1TP53 |
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-2021127359-A1 | USE OF LEMBOREXANT FOR TREATING INSOMNIA | EISAI R&D MANAGEMENT CO., LTD. (JP) | 2021-06-24 | — | — | WO | disclosed |