Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.52 |
| ▸ | RAB9A | P51151 | 3/20 | 0.52 |
| ▸ | CA12 | O43570 | 1/20 | 0.52 |
| ▸ | CA9 | Q16790 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | GLA | P06280 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | TSPO | P30536 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | RIPK1 | Q13546 | 2/20 | 0.45 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL17333394 | 0.85 | NPC1 (0.53) | NPC1RAB9ACA12CA9LMNA | |
| SCHEMBL1255010 | 0.81 | CA12 (0.55) | NPC1RAB9ACA12CA9LMNA | |
| SCHEMBL6433208 | 0.80 | ALDH1A1 (0.64) | NPC1RAB9ALMNAOPRM1ALDH1A1 | |
| SCHEMBL3837997 | 0.80 | CA12 (0.55) | NPC1RAB9ACA12CA9LMNA | |
| SCHEMBL17796003 | 0.78 | ALOX5 (0.61) | NPC1RAB9ACA12CA9LMNA | |
| SCHEMBL3163935 | 0.78 | NPC1 (0.75) | NPC1RAB9ACA12CA9ALDH1A1 | |
| SCHEMBL27696233 | 0.77 | NPC1 (0.52) | NPC1RAB9ACA12CA9LMNA | |
| SCHEMBL13198054 | 0.77 | NPC1 (0.52) | NPC1RAB9ACA12CA9LMNA | |
| SCHEMBL817991 | 0.77 | NPC1 (0.47) | NPC1RAB9ACA12CA9LMNA | |
| SCHEMBL23805051 | 0.76 | CA12 (0.50) | NPC1RAB9ACA12CA9LMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-115666513-A | Novel pharmaceutical compositions for drug delivery | 奥瑞克索股份公司 | 2023-01-31 | — | — | CN | disclosed |