Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.30 |
| ▸ | AKT1 | P31749 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9243178 | 1.00 | NPC1 (0.33) | NPC1RAB9ASMN1; SMN2HSD17B10RPS6KB1 | |
| SCHEMBL9247929 | 0.97 | NPC1 (0.33) | NPC1RAB9ASMN1; SMN2HSD17B10RPS6KB1 | |
| SCHEMBL9247935 | 0.97 | NPC1 (0.33) | NPC1RAB9ASMN1; SMN2HSD17B10RPS6KB1 | |
| SCHEMBL9247648 | 0.94 | RPS6KB1 (0.31) | NPC1RAB9ASMN1; SMN2HSD17B10RPS6KB1 | |
| SCHEMBL9247654 | 0.94 | RPS6KB1 (0.31) | NPC1RAB9ASMN1; SMN2HSD17B10RPS6KB1 | |
| SCHEMBL9243088 | 0.91 | NPC1 (0.33) | NPC1RAB9ASMN1; SMN2HSD17B10 | |
| SCHEMBL9243084 | 0.91 | NPC1 (0.33) | NPC1RAB9ASMN1; SMN2HSD17B10 | |
| SCHEMBL9245397 | 0.89 | KDM4E (0.33) | NPC1RAB9ASMN1; SMN2HSD17B10RPS6KB1 | |
| SCHEMBL9245402 | 0.89 | KDM4E (0.33) | NPC1RAB9ASMN1; SMN2HSD17B10RPS6KB1 | |
| SCHEMBL9246012 | 0.88 | PDE5A (0.33) | NPC1RAB9ASMN1; SMN2HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| US-5447657-A | Liquid crystal compounds | HOFFMANN-LA ROCHE INC. (US) | 1995-09-05 | — | — | US | disclosed |