Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 1/20 | 0.61 |
| ▸ | ESR1 | P03372 | 4/20 | 0.61 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.61 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.52 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | HTR1A | P08908 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | HTR3A | P46098 | 1/20 | 0.52 |
| ▸ | BACE1 | P56817 | 1/20 | 0.52 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | BLM | P54132 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.46 |
| ▸ | IGF1R | P08069 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL9842754 | 0.83 | ESR1 (0.61) | LTA4HESR1ESR2ADRA2ASLC6A2 | |
| SCHEMBL3234718 | 0.81 | ESR1 (0.58) | LTA4HESR1ESR2ADRA2ASLC6A2 | |
| SCHEMBL16105773 | 0.81 | CES2 (0.39) | LTA4HKDM4EALDH1A1TAAR1CA2 | |
| SCHEMBL3873458 | 0.78 | ESR1 (1.00) | LTA4HESR1ESR2ADRA2ASLC6A2 | |
| SCHEMBL69344 | 0.78 | ESR1 (1.00) | LTA4HESR1ESR2ADRA2ASLC6A2 | |
| SCHEMBL7733392 | 0.77 | HTR2A (0.48) | ALDH1A1CYP2C19TAAR1L3MBTL1TDP1 | |
| SCHEMBL716875 | 0.77 | ESR1 (0.67) | LTA4HESR1ESR2ADRA2ASLC6A2 | |
| SCHEMBL6516762 | 0.77 | ESR1 (0.74) | LTA4HESR1ESR2ADRA2ASLC6A2 | |
| Dihydroresveratrol SCHEMBL716856 | 0.77 | LTA4H (1.00) | LTA4HESR1ESR2ADRA2ASLC6A2 | |
| SCHEMBL8050434 | 0.76 | ALDH1A1 (0.47) | KDM4EALDH1A1KMT2ALMNATP53 |
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-0786445-B1 | DIFLUOROXYMETHANE DERIVATIVE AND LIQUID CRYSTAL COMPOSITION | CHISSO CORP (JP) | 2002-07-17 | — | — | EP | disclosed |
| US-5858270-A | Difluorooxymethane derivative and liquid crystal composition | CHISSO CORPORATION (JP) | 1999-01-12 | — | — | US | disclosed |
| EP-0786445-A1 | DIFLUOROXYMETHANE DERIVATIVE AND LIQUID CRYSTAL COMPOSITION | CHISSO CORPORATION (JP) | 1997-07-30 | — | — | EP | disclosed |