Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.55 |
| ▸ | CES1 | P23141 | 2/20 | 0.55 |
| ▸ | CA1 | P00915 | 5/20 | 0.53 |
| ▸ | CA2 | P00918 | 5/20 | 0.53 |
| ▸ | PARP1 | P09874 | 1/20 | 0.52 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.52 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.52 |
| ▸ | PARP4 | Q9UKK3 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 2/20 | 0.52 |
| ▸ | TCF4 | P15884 | 1/20 | 0.51 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | ESR1 | P03372 | 1/20 | 0.50 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL6656342 | 0.87 | CA1 (0.57) | CES2CES1CA1CA2PARP1 | |
| SCHEMBL6656346 | 0.87 | CA1 (0.57) | CES2CES1CA1CA2PARP1 | |
| SCHEMBL6656347 | 0.87 | CA1 (0.57) | CES2CES1CA1CA2PARP1 | |
| SCHEMBL28858524 | 0.82 | CES2 (0.56) | CES2CES1CA1CA2PARP1 | |
| SCHEMBL28858520 | 0.82 | CES2 (0.56) | CES2CES1CA1CA2PARP1 | |
| SCHEMBL28427034 | 0.81 | CES2 (0.59) | CES2CES1CA1CA2CYP2C19 | |
| SCHEMBL28417426 | 0.81 | CES2 (0.59) | CES2CES1CA1CA2CYP2C19 | |
| SCHEMBL22288 | 0.77 | CES2 (0.67) | CES2CES1CA1CA2PARP1 | |
| SCHEMBL11182680 | 0.77 | TCF4 (0.56) | CES2CES1CA1CA2PARP1 | |
| SCHEMBL11161016 | 0.77 | TCF4 (0.56) | CES2CES1CA1CA2PARP1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6146547-A | USEFUL AS COMPONENT OF FERROELECTRIC LIQUID CRYSTAL FORMULATIONS | CHISSO CORPORATION (JP) | 2000-11-14 | — | — | US | disclosed |
| EP-0278665-B1 | 2-Substituted-alkyl ether and liquid crystal composition | CHISSO CORP (JP) | 1994-09-21 | — | — | EP | disclosed |
| US-5120468-A | Optical active mixture exhibiting ferroelectricity | CHISSO CORPORATION (JP) | 1992-06-09 | — | — | US | disclosed |
| EP-0278665-A2 | 2-Substituted-alkyl ether and liquid crystal composition | Chisso Corporation (JP) | 1988-08-17 | — | — | EP | disclosed |