Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.58 |
| ▸ | RAB9A | P51151 | 2/20 | 0.58 |
| ▸ | SCN4A | P35499 | 2/20 | 0.58 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.58 |
| ▸ | GMNN | O75496 | 1/20 | 0.58 |
| ▸ | USP2 | O75604 | 1/20 | 0.58 |
| ▸ | LMNA | P02545 | 1/20 | 0.58 |
| ▸ | TP53 | P04637 | 1/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.58 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.58 |
| ▸ | GAA | P10253 | 1/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.58 |
| ▸ | PKM | P14618 | 1/20 | 0.58 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.58 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.58 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.58 |
| ▸ | BLM | P54132 | 1/20 | 0.58 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.58 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL18190847 | 0.99 | NPC1 (0.59) | NPC1RAB9ASCN4ASCN9AGMNN | |
| Hydrochloric Acid SCHEMBL18190932 | 0.83 | DYRK1A (0.57) | NPC1RAB9ASCN4ASCN9AGMNN | |
| SCHEMBL13729470 | 0.81 | NPC1 (0.62) | NPC1RAB9ASCN4ASCN9AGMNN | |
| SCHEMBL3086757 | 0.79 | NPC1 (0.63) | NPC1RAB9ASCN4ASCN9AGMNN | |
| SCHEMBL28588889 | 0.77 | NPC1 (0.60) | NPC1RAB9ASCN4ASCN9AGMNN | |
| SCHEMBL21568256 | 0.76 | DYRK1A (0.77) | NPC1RAB9ASCN4ASCN9AGMNN | |
| SCHEMBL3635567 | 0.75 | NPC1 (0.61) | NPC1RAB9ASCN4ASCN9AGMNN | |
| Riluzole SCHEMBL4443848 | 0.74 | RAB9A (0.82) | NPC1RAB9ASCN4ASCN9AGMNN | |
| SCHEMBL20511690 | 0.74 | CYP1A2 (0.56) | NPC1RAB9ASCN4ASCN9AGMNN | |
| SCHEMBL16445830 | 0.74 | DYRK1A (0.73) | NPC1RAB9ASCN4ASCN9AGMNN |
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-2016140878-A9 | PRODRUGS RILUZOLE AND THEIR METHOD OF USE | BIOHAVEN PHARMACEUTICAL HOLDING COMPANY LTD. (US) | 2016-10-20 | — | — | WO | disclosed |