Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.56 |
| ▸ | CES1 | P23141 | 2/20 | 0.54 |
| ▸ | CES2 | O00748 | 1/20 | 0.54 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.46 |
| ▸ | CRHBP | P24387 | 1/20 | 0.46 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.46 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL28064881 | 0.94 | CES2 (0.54) | SMN1; SMN2CES1CES2ALOX5POLB | |
| SCHEMBL8741192 | 0.84 | ALDH1A1 (0.60) | SMN1; SMN2CES1CES2ALOX5POLB | |
| SCHEMBL39276 | 0.82 | TDP1 (0.57) | CES1CES2TDP1ALDH1A1KMT2A | |
| SCHEMBL5973956 | 0.81 | ALOX5 (0.73) | SMN1; SMN2CES1CES2ALOX5POLB | |
| SCHEMBL27421509 | 0.79 | ALOX5 (0.60) | SMN1; SMN2CES1CES2ALOX5POLB | |
| SCHEMBL8578508 | 0.79 | GAA (0.59) | SMN1; SMN2CES1CES2MAPK1TDP1 | |
| SCHEMBL20598049 | 0.78 | RAB9A (0.58) | SMN1; SMN2CES1CES2ALOX5POLB | |
| SCHEMBL28114850 | 0.78 | CES1 (0.67) | SMN1; SMN2CES1CES2ALOX5POLB | |
| SCHEMBL4908654 | 0.78 | MAPK1 (0.55) | SMN1; SMN2CES1CES2POLBMAPK1 | |
| SCHEMBL762542 | 0.78 | CES1 (0.77) | SMN1; SMN2CES1CES2POLBMAPK1 |
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-105566384-A | Method for preparing (E)-2-aryl-alpha, beta-unsaturated carbonyl phosphonate derivative | HENAN INST ENGINEERING | 2016-05-11 | — | — | CN | disclosed |