Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.39 |
| ▸ | RORC | P51449 | 2/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | BACE1 | P56817 | 1/20 | 0.37 |
| ▸ | NAAA | Q02083 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9810622 | 0.88 | GAA (0.43) | ALDH1A1NPC1RAB9ASMN1; SMN2MEN1 | |
| SCHEMBL9810350 | 0.88 | SLC6A2 (0.43) | PKMALDH1A1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL9810293 | 0.86 | DRD2 (0.38) | ALDH1A1NPC1RAB9ASMN1; SMN2MEN1 | |
| SCHEMBL9810475 | 0.85 | ALDH1A1 (0.39) | ALDH1A1NPC1RAB9ASMN1; SMN2MEN1 | |
| SCHEMBL9810392 | 0.83 | ALDH1A1 (0.37) | ALDH1A1NPC1RAB9ASMN1; SMN2MEN1 | |
| SCHEMBL9810421 | 0.82 | PPARG (0.37) | ALDH1A1RAB9ASMN1; SMN2MEN1KMT2A | |
| SCHEMBL9810401 | 0.82 | PPARG (0.37) | ALDH1A1RAB9ASMN1; SMN2MEN1KMT2A | |
| SCHEMBL9810635 | 0.81 | DRD2 (0.34) | ALDH1A1NPC1RAB9ASMN1; SMN2MEN1 | |
| SCHEMBL9810260 | 0.79 | ALDH1A1 (0.35) | ALDH1A1MEN1KMT2AL3MBTL1NAAA | |
| SCHEMBL22269082 | 0.79 | ALDH1A1 (0.51) | ALDH1A1NPC1RAB9ASMN1; SMN2MEN1 |
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-5068389-A | TERTIARY ALCOHOLS | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1991-11-26 | — | — | US | disclosed |