Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | FAAH | O00519 | 5/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 3/20 | 0.34 |
| ▸ | GPR84 | Q9NQS5 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8595908 | 0.94 | CES2 (0.44) | CES2TSHRMAPTFAAHTP53 | |
| SCHEMBL8599478 | 0.93 | CES2 (0.47) | CES2TSHRMAPTFAAHTP53 | |
| SCHEMBL8595349 | 0.93 | CES2 (0.47) | CES2TSHRMAPTFAAHTP53 | |
| SCHEMBL8599725 | 0.93 | CES2 (0.47) | CES2TSHRMAPTFAAHTP53 | |
| SCHEMBL8598637 | 0.93 | CES2 (0.47) | CES2TSHRMAPTFAAHTP53 | |
| SCHEMBL8598285 | 0.93 | CES2 (0.47) | CES2TSHRMAPTFAAHTP53 | |
| SCHEMBL8596144 | 0.88 | CHRM1 (0.33) | CES2MAPTHCAR2 | |
| SCHEMBL10825869 | 0.85 | CES2 (0.38) | CES2ALDH1A1TSHRHPGDFAAH | |
| Fluoride SCHEMBL29059068 | 0.83 | CES2 (0.46) | CES2MAPTFAAHCES1 | |
| SCHEMBL8860653 | 0.83 | ALDH1A1 (0.45) | CES2ALDH1A1TSHRHPGDFAAH |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0592669-B1 | OPTICALLY ACTIVE TRIFLUOROLACTIC ACID DERIVATIVE AND LIQUID CRYSTAL COMPOSITION | CHISSO CORP (JP) | 1998-01-28 | — | — | EP | disclosed |
| US-5665270-A | Optically active trifluorolactic acid derivative and liquid crystal composition | CHISSO CORPORATION (JP) | 1997-09-09 | — | — | US | disclosed |
| EP-0592669-A1 | OPTICALLY ACTIVE TRIFLUOROLACTIC ACID DERIVATIVE AND LIQUID CRYSTAL COMPOSITION | CHISSO CORPORATION (JP) | 1994-04-20 | — | — | EP | disclosed |