Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | PKM | P14618 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MITF | O75030 | 1/20 | 0.41 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | AHR | P35869 | 1/20 | 0.38 |
| ▸ | PLCG1 | P19174 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7828236 | 0.81 | L3MBTL1 (0.47) | ALDH1A1SMN1; SMN2L3MBTL1KDM4EPTGS2 | |
| SCHEMBL504847 | 0.78 | PLCG1 (0.51) | ALDH1A1SMN1; SMN2L3MBTL1NPC1PKM | |
| SCHEMBL28403522 | 0.78 | SMN1; SMN2 (0.47) | ALDH1A1POLBSMN1; SMN2L3MBTL1NPC1 | |
| SCHEMBL10334728 | 0.77 | SMN1; SMN2 (0.46) | ALDH1A1POLBSMN1; SMN2L3MBTL1NPC1 | |
| SCHEMBL20166133 | 0.77 | AHR (0.47) | ALDH1A1POLBSMN1; SMN2L3MBTL1NPC1 | |
| SCHEMBL9978324 | 0.77 | SMN1; SMN2 (0.46) | ALDH1A1SMN1; SMN2L3MBTL1NPC1PKM | |
| SCHEMBL11001068 | 0.77 | SMN1; SMN2 (0.50) | ALDH1A1SMN1; SMN2L3MBTL1NPC1PKM | |
| SCHEMBL5700780 | 0.75 | SMN1; SMN2 (0.44) | ALDH1A1POLBSMN1; SMN2L3MBTL1NPC1 | |
| SCHEMBL1027526 | 0.75 | AHR (0.46) | SMN1; SMN2L3MBTL1KDM4EKCNN4BLM | |
| SCHEMBL24895507 | 0.75 | ALDH1A1 (0.39) | ALDH1A1POLBSMN1; SMN2RAB9ACYP2C19 |
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-107529803-B | Flavor modulator containing pyridine derivative or its salt as active ingredient | 长谷川香料株式会社 | 2021-03-30 | — | — | CN | disclosed |