Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.72 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.72 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.72 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.72 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.72 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.72 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.71 |
| ▸ | LMNA | P02545 | 1/20 | 0.71 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.71 |
| ▸ | CTSK | P43235 | 3/20 | 0.54 |
| ▸ | HTR2A | P28223 | 2/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.42 |
| ▸ | HRH1 | P35367 | 1/20 | 0.42 |
| ▸ | HTR2B | P41595 | 1/20 | 0.42 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | PPARA | Q07869 | 4/20 | 0.42 |
| ▸ | PPARG | P37231 | 3/20 | 0.42 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9669156 | 0.91 | CYP3A4 (0.67) | CYP3A4CYP1A2CYP2D6CYP2C9NFKB1 | |
| SCHEMBL9669060 | 0.90 | CYP3A4 (0.74) | CYP3A4CYP1A2CYP2D6CYP2C9NFKB1 | |
| SCHEMBL9668331 | 0.88 | CYP3A4 (0.56) | CYP3A4CYP1A2CYP2D6CYP2C9NFKB1 | |
| SCHEMBL17512983 | 0.87 | CYP3A4 (0.74) | CYP3A4CYP1A2CYP2D6CYP2C9NFKB1 | |
| SCHEMBL17512959 | 0.85 | CYP3A4 (0.67) | CYP3A4CYP1A2CYP2D6CYP2C9NFKB1 | |
| SCHEMBL9667731 | 0.85 | CYP3A4 (0.75) | CYP3A4CYP1A2CYP2D6CYP2C9NFKB1 | |
| (S)-Alaproclate SCHEMBL23928818 | 0.84 | CYP3A4 (1.00) | CYP3A4CYP1A2CYP2D6CYP2C9NFKB1 | |
| Alaproclate SCHEMBL5784981 | 0.84 | CYP3A4 (1.00) | CYP3A4CYP1A2CYP2D6CYP2C9NFKB1 | |
| Alaproclate SCHEMBL34357 | 0.84 | CYP3A4 (1.00) | CYP3A4CYP1A2CYP2D6CYP2C9NFKB1 | |
| Alaproclate SCHEMBL29481071 | 0.84 | CYP3A4 (1.00) | CYP3A4CYP1A2CYP2D6CYP2C9NFKB1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0293351-B1 | NEW ARALKYL ESTERS AND PROCESSES FOR THEIR PREPARATION | AKTIEBOLAGET ASTRA (SE) | 1992-03-25 | — | — | EP | disclosed |
| US-4990534-A | Aralkyl esters and processes for their preparation | AKTIEBOLAGET ASTRA (SE) | 1991-02-05 | — | — | US | disclosed |
| EP-0362264-A1 | NEW ARALKYL ESTERS AND PROCESSES FOR THEIR PREPARATION | AKTIEBOLAGET ASTRA (SE) | 1990-04-11 | — | — | EP | disclosed |
| WO-1988009327-A1 | NEW ARALKYL ESTERS AND PROCESSES FOR THEIR PREPARATION | AKTIEBOLAGET ASTRA (SE) | 1988-12-01 | — | — | WO | disclosed |
| EP-0293351-A2 | New aralkyl esters and processes for their preparation | AKTIEBOLAGET ASTRA (SE) | 1988-11-30 | — | — | EP | disclosed |