Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 2/20 | 0.54 |
| ▸ | CES2 | O00748 | 1/20 | 0.54 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.54 |
| ▸ | ALOX5 | P09917 | 4/20 | 0.49 |
| ▸ | REN | P00797 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.47 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.46 |
| ▸ | FNTA | P49354 | 1/20 | 0.45 |
| ▸ | FNTB | P49356 | 1/20 | 0.45 |
| ▸ | CTSD | P07339 | 1/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL27822859 | 0.82 | CES1 (0.58) | CES1CES2AKR1B1ALOX5REN | |
| SCHEMBL11321849 | 0.81 | CES1 (0.52) | CES1CES2AKR1B1ALOX5REN | |
| SCHEMBL4430452 | 0.81 | CES2 (0.52) | CES1CES2AKR1B1ALOX5REN | |
| SCHEMBL3256370 | 0.79 | ALOX5 (0.61) | ALOX5MEN1KMT2AHDAC8HDAC6 | |
| SCHEMBL7564972 | 0.79 | CES2 (0.50) | CES1CES2AKR1B1ALOX5REN | |
| SCHEMBL17224008 | 0.78 | CES2 (0.54) | CES1CES2AKR1B1ALOX5REN | |
| SCHEMBL2948755 | 0.78 | ALOX5 (0.72) | CES1CES2AKR1B1ALOX5TRPM8 | |
| SCHEMBL4700427 | 0.78 | CES2 (0.48) | CES1CES2AKR1B1ALOX5REN | |
| SCHEMBL28185013 | 0.78 | CES1 (0.48) | CES1CES2AKR1B1ALOX5REN | |
| SCHEMBL9061013 | 0.78 | CES2 (0.48) | CES1CES2AKR1B1ALOX5REN |
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-109721586-A | A kind of 5- benzyl -3- pyridyl group -1H-1,2,4- triazole class compounds and its preparation method and application | 中国医科大学 | 2019-05-07 | — | — | CN | disclosed |