Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CES2 | O00748 | 1/20 | 0.31 |
| ▸ | CES1 | P23141 | 1/20 | 0.31 |
| ▸ | DGKA | P23743 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.30 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.30 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.30 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.30 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL27857741 | 0.91 | DGKA (0.37) | ALDH1A1CES2CES1DGKACYP1A2 | |
| SCHEMBL27857783 | 0.89 | DGKA (0.44) | ALDH1A1CES2CES1DGKA | |
| SCHEMBL27857681 | 0.84 | NAAA (0.32) | ALDH1A1 | |
| SCHEMBL27857742 | 0.80 | CA1 (0.35) | — | |
| SCHEMBL22915377 | 0.78 | DGKA (0.42) | ALDH1A1CES2CES1DGKA | |
| SCHEMBL27316330 | 0.76 | DGKA (0.45) | ALDH1A1CES2CES1DGKA | |
| SCHEMBL28937523 | 0.76 | DGKA (0.45) | ALDH1A1CES2CES1DGKA | |
| SCHEMBL27427969 | 0.76 | DGKA (0.45) | ALDH1A1CES2CES1DGKA | |
| SCHEMBL27857733 | 0.76 | MMP1 (0.35) | ALDH1A1 | |
| SCHEMBL7785942 | 0.75 | CES1 (0.44) | ALDH1A1CES2CES1DGKA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102471252-B | Process for producing (fluoroalkylthio) acetic acid ester | SUMITOMO CHEMICAL CO | 2014-07-02 | — | — | CN | disclosed |
| CN-103709079-A | Process for preparation of (fluoroalkylthio)acetic acid esters | MASAJI HIROTA HIROYUKI MIYAZAKI TADAYOSHI ITOH | 2014-04-09 | — | — | CN | disclosed |