Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | POLB | P06746 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.41 |
| ▸ | CES2 | O00748 | 1/20 | 0.40 |
| ▸ | CES1 | P23141 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.39 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL27964089 | 0.83 | MAPT (0.44) | KMT2AALDH1A1POLBMEN1KDM4E | |
| SCHEMBL9402238 | 0.83 | MAPT (0.44) | KMT2AALDH1A1POLBMEN1KDM4E | |
| Hydrochloric Acid SCHEMBL9402285 | 0.82 | MAPT (0.43) | KMT2AALDH1A1POLBMEN1KDM4E | |
| SCHEMBL5041397 | 0.82 | MAPT (0.43) | KMT2AALDH1A1POLBMEN1KDM4E | |
| SCHEMBL637383 | 0.80 | MAPT (0.42) | KMT2AALDH1A1POLBMEN1KDM4E | |
| SCHEMBL3513098 | 0.80 | MAPT (0.42) | KMT2AALDH1A1POLBMEN1KDM4E | |
| Bicarbonate SCHEMBL28968865 | 0.79 | MAPT (0.49) | KMT2AALDH1A1POLBMEN1KDM4E | |
| SCHEMBL2075002 | 0.77 | PTPN1 (0.42) | KMT2AALDH1A1POLBMEN1KDM4E | |
| SCHEMBL8478567 | 0.77 | PTPN1 (0.42) | KMT2AALDH1A1POLBMEN1KDM4E | |
| SCHEMBL27396838 | 0.77 | PTPN1 (0.42) | KMT2AALDH1A1POLBMEN1KDM4E |
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-108033916-B | Preparation of amino acid ester compound and application of amino acid ester compound in preventing and treating tobacco diseases | 贵州理工学院 | 2021-02-26 | — | — | CN | disclosed |