Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.47 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.44 |
| ▸ | APP | P05067 | 1/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 4/20 | 0.40 |
| ▸ | RAB9A | P51151 | 4/20 | 0.40 |
| ▸ | AR | P10275 | 1/20 | 0.40 |
| ▸ | RYR2 | Q92736 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL30804400 | 0.90 | ALDH1A1 (0.45) | ALDH1A1KDM4EMTNR1AMTNR1BHRH3 | |
| SCHEMBL418525 | 0.80 | ALDH1A1 (0.59) | ALDH1A1KDM4EMTNR1AMTNR1BHRH3 | |
| SCHEMBL5167250 | 0.77 | ALDH1A1 (0.56) | ALDH1A1KDM4EMTNR1AMTNR1BHRH3 | |
| SCHEMBL9808184 | 0.77 | ALDH1A1 (0.56) | ALDH1A1KDM4EMTNR1AMTNR1BHRH3 | |
| SCHEMBL9770431 | 0.75 | ALDH1A1 (0.54) | ALDH1A1KDM4EMTNR1AMTNR1BHRH3 | |
| SCHEMBL9348226 | 0.75 | ALDH1A1 (0.54) | ALDH1A1KDM4EMTNR1AMTNR1BHRH3 | |
| SCHEMBL6123648 | 0.75 | ALDH1A1 (0.54) | ALDH1A1KDM4EMTNR1AMTNR1BHRH3 | |
| SCHEMBL5172139 | 0.75 | ALDH1A1 (0.54) | ALDH1A1KDM4EMTNR1AMTNR1BHRH3 | |
| SCHEMBL29173287 | 0.74 | ALDH1A1 (0.58) | ALDH1A1KDM4EMTNR1AMTNR1BHRH3 | |
| SCHEMBL2153559 | 0.73 | ALDH1A1 (0.53) | ALDH1A1KDM4EMTNR1AMTNR1BHRH3 |
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-117702142-A | C (C) 4 Process for preparing substituted pyridine derivatives | 五邑大学 | 2024-03-15 | — | — | CN | disclosed |