Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | G6PC1 | P35575 | 1/20 | 0.41 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.39 |
| ▸ | ADH1B | P00325 | 1/20 | 0.38 |
| ▸ | ADH1C | P00326 | 1/20 | 0.38 |
| ▸ | ADH1A | P07327 | 1/20 | 0.38 |
| ▸ | ADH7 | P40394 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL26802 | 0.87 | ALDH1A1 (0.48) | ALDH1A1NPC1RAB9ATSHRG6PC1 | |
| SCHEMBL17333532 | 0.84 | ALDH1A1 (0.40) | ALDH1A1NPC1RAB9AGLAHTT | |
| SCHEMBL5548405 | 0.80 | G6PC1 (0.49) | G6PC1TDP1KDM4EMEN1MAPT | |
| SCHEMBL17333698 | 0.80 | MEN1 (0.49) | ALDH1A1NPC1RAB9AAOC3TDP1 | |
| SCHEMBL968495 | 0.79 | LMNA (0.48) | ALDH1A1NPC1RAB9ATSHRAOC3 | |
| SCHEMBL7087904 | 0.79 | TSHR (0.41) | ALDH1A1NPC1RAB9AHTTTSHR | |
| SCHEMBL5522932 | 0.78 | TAAR1 (0.47) | ALDH1A1NPC1RAB9AHTTTSHR | |
| SCHEMBL5522934 | 0.78 | TAAR1 (0.47) | ALDH1A1NPC1RAB9AHTTTSHR | |
| SCHEMBL17333434 | 0.77 | MEN1 (0.46) | NPC1RAB9AAOC3TDP1MEN1 | |
| SCHEMBL5540778 | 0.76 | L3MBTL1 (0.45) | ALDH1A1RAB9AHTTSMN1; SMN2TSHR |
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-104969406-A | Electrolyte solution for electrochemical device and electrochemical device | WAKO PURE CHEM IND LTD | 2015-10-07 | — | — | CN | disclosed |