Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | SLC2A1 | P11166 | 2/20 | 0.48 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | CASP1 | P29466 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | LTA4H | P09960 | 3/20 | 0.45 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.44 |
| ▸ | S1PR3 | Q99500 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11528467 | 0.98 | NPC1 (0.49) | NPC1RAB9ASLC2A1NR5A1L3MBTL1 | |
| SCHEMBL11531871 | 0.97 | SLC2A1 (0.48) | NPC1RAB9ASLC2A1NR5A1L3MBTL1 | |
| SCHEMBL11526403 | 0.97 | SLC2A1 (0.51) | NPC1RAB9ASLC2A1NR5A1L3MBTL1 | |
| SCHEMBL11529059 | 0.95 | NPC1 (0.53) | NPC1RAB9ASLC2A1NR5A1L3MBTL1 | |
| SCHEMBL11527989 | 0.92 | SLC2A1 (0.55) | NPC1RAB9ASLC2A1NR5A1L3MBTL1 | |
| SCHEMBL11526412 | 0.92 | SLC2A1 (0.51) | NPC1RAB9ASLC2A1NR5A1L3MBTL1 | |
| SCHEMBL11532572 | 0.92 | NPC1 (0.47) | NPC1RAB9ASLC2A1NR5A1L3MBTL1 | |
| SCHEMBL11531343 | 0.90 | NPC1 (0.46) | NPC1RAB9ASLC2A1NR5A1L3MBTL1 | |
| SCHEMBL11534494 | 0.90 | NPC1 (0.46) | NPC1RAB9ASLC2A1NR5A1L3MBTL1 | |
| SCHEMBL11533241 | 0.88 | L3MBTL1 (0.47) | NPC1RAB9ASLC2A1L3MBTL1ALDH1A1 |
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-4161474-A | STABILIZERS, ANTIOZONANTS FOR VULCANIZABLE DIENE RUBBERS | MONSANTO COMPANY (US) | 1979-07-17 | — | — | US | disclosed |