Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.86 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.60 |
| ▸ | F7 | P08709 | 1/20 | 0.59 |
| ▸ | F3 | P13726 | 1/20 | 0.59 |
| ▸ | SARM1 | Q6SZW1 | 1/20 | 0.59 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.59 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.59 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.59 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.59 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.59 |
| ▸ | SIRT4 | Q9Y6E7 | 1/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 1/20 | 0.52 |
| ▸ | APP | P05067 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.52 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.52 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| Methyl Nicotinate SCHEMBL28210706 | 0.93 | ALDH1A1 (0.93) | ALDH1A1KMT2AF7F3SARM1 | |
| Methyl Nicotinate SCHEMBL29386553 | 0.93 | ALDH1A1 (1.00) | ALDH1A1KMT2AF7F3SARM1 | |
| Methyl Nicotinate SCHEMBL820747 | 0.93 | ALDH1A1 (1.00) | ALDH1A1KMT2AF7F3SARM1 | |
| Methyl Nicotinate SCHEMBL24566 | 0.93 | ALDH1A1 (1.00) | ALDH1A1KMT2AF7F3SARM1 | |
| Methyl Nicotinate SCHEMBL28657691 | 0.92 | ALDH1A1 (0.83) | ALDH1A1KMT2AF7F3SARM1 | |
| Methyl Nicotinate SCHEMBL28181205 | 0.91 | ALDH1A1 (0.89) | ALDH1A1KMT2AF7F3SARM1 | |
| Methyl Nicotinate SCHEMBL11491005 | 0.91 | ALDH1A1 (0.96) | ALDH1A1KMT2AF7F3SARM1 | |
| Methyl Nicotinate SCHEMBL29527047 | 0.91 | ALDH1A1 (0.96) | ALDH1A1KMT2AF7F3SARM1 | |
| Methyl Nicotinate SCHEMBL28370871 | 0.91 | ALDH1A1 (0.96) | ALDH1A1KMT2AF7F3SARM1 | |
| Methyl Nicotinate SCHEMBL30668199 | 0.91 | ALDH1A1 (0.96) | ALDH1A1KMT2AF7F3SARM1 |
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-104870422-B | Amine derivative or its salt | 富士胶片富山化学株式会社 | 2019-03-15 | — | — | CN | disclosed |