Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 1/20 | 0.37 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.32 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.32 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.30 |
| ▸ | FAAH | O00519 | 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 | |
|---|---|---|---|---|
| SCHEMBL7558018 | 0.94 | CES1 (0.36) | CES1CES2TSHRALDH1A1ADRB2 | |
| SCHEMBL7566221 | 0.92 | CES1 (0.47) | CES1CES2FAAH | |
| SCHEMBL7558796 | 0.92 | CES1 (0.47) | CES1CES2FAAH | |
| SCHEMBL7558673 | 0.92 | CES1 (0.47) | CES1CES2FAAH | |
| SCHEMBL7563945 | 0.87 | CES1 (0.43) | CES1CES2TSHR | |
| SCHEMBL7754453 | 0.83 | TSHR (0.41) | CES1CES2TSHR | |
| SCHEMBL9345099 | 0.82 | CES1 (0.35) | CES1CES2TSHRALDH1A1ADRB2 | |
| SCHEMBL7750849 | 0.81 | TSHR (0.39) | CES1CES2TSHR | |
| SCHEMBL7754447 | 0.81 | TSHR (0.39) | CES1CES2TSHR | |
| SCHEMBL4870644 | 0.80 | CES1 (0.34) | CES1CES2TSHRADRB2ADRB1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0638112-B1 | LIQUID CRYSTAL COMPOUNDS HAVING PERFLUOROETHER TERMINAL PORTIONS | MINNESOTA MINING & MFG (US) | 2002-08-07 | — | — | EP | disclosed |
| EP-0792255-B1 | LIQUID CRYSTAL COMPOUNDS HAVING PERFLUOROETHER TERMINAL PORTIONS | MINNESOTA MINING & MFG (US) | 2001-02-28 | — | — | EP | disclosed |