Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | CES2 | O00748 | 2/20 | 0.39 |
| ▸ | CES1 | P23141 | 2/20 | 0.39 |
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.34 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.34 |
| ▸ | SLC2A4 | P14672 | 1/20 | 0.34 |
| ▸ | CTSB | P07858 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | FAAH | O00519 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28200073 | 0.81 | KMT2A (0.43) | ALDH1A1GAACES2CES1BCHE | |
| SCHEMBL28692786 | 0.77 | KMT2A (0.45) | ALDH1A1GAACES2CES1BCHE | |
| SCHEMBL15836535 | 0.76 | KMT2A (0.44) | ALDH1A1GAACES2CES1BCHE | |
| SCHEMBL19358651 | 0.76 | CES2 (0.41) | ALDH1A1CES2CES1BCHEKMT2A | |
| SCHEMBL15763907 | 0.75 | CES2 (0.44) | ALDH1A1GAACES2CES1BCHE | |
| SCHEMBL6966438 | 0.74 | CES2 (0.47) | ALDH1A1CES2CES1BCHEKMT2A | |
| SCHEMBL28200122 | 0.73 | KMT2A (0.40) | ALDH1A1GAAKMT2AMAPTNPC1 | |
| SCHEMBL31200468 | 0.73 | MAPK1 (0.49) | ALDH1A1GAACES2CES1BCHE | |
| SCHEMBL1700833 | 0.73 | MAPK1 (0.49) | ALDH1A1GAACES2CES1BCHE | |
| SCHEMBL27555847 | 0.72 | CES2 (0.41) | ALDH1A1GAACES2CES1BCHE |
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-107663161-A | A kind of continuous stream synthesis technique of phenylhydrazine salt and substituted benzene hydrazonium salt | 上海惠和化德生物科技有限公司 | 2018-02-06 | — | — | CN | disclosed |