Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VCAM1 | P19320 | 7/20 | 0.33 |
| ▸ | TOP1 | P11387 | 1/20 | 0.33 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.32 |
| ▸ | ESRRA | P11474 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 2/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | XBP1 | P17861 | 1/20 | 0.30 |
| ▸ | ATM | Q13315 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | NLRP3 | Q96P20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7523672 | 0.87 | BACE1 (0.39) | VCAM1MAPT | |
| SCHEMBL8839727 | 0.86 | BACE1 (0.38) | VCAM1ALDH1A1 | |
| SCHEMBL7526592 | 0.85 | MEN1 (0.32) | VCAM1NR1H4ALDH1A1MAPT | |
| SCHEMBL7516554 | 0.83 | GAA (0.34) | VCAM1TOP1NR1H4GAAMAPT | |
| SCHEMBL7517877 | 0.83 | CA2 (0.41) | NR1H4GAAALDH1A1MAPTATM | |
| SCHEMBL8517276 | 0.80 | ADORA3 (0.35) | NR1H4GAAALDH1A1MAPTATM | |
| SCHEMBL7521161 | 0.78 | ALDH1A1 (0.42) | NR1H4ESRRAGAAALDH1A1MAPT | |
| SCHEMBL7522909 | 0.78 | HTT (0.39) | TOP1GAAALDH1A1HSP90AA1MAPT | |
| SCHEMBL7524096 | 0.75 | VCAM1 (0.38) | VCAM1MAPT | |
| SCHEMBL7523688 | 0.74 | VCAM1 (0.35) | VCAM1GAAALDH1A1MAPTXBP1 |
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-0900225-B1 | ALKYL-4-SILYL-PHENOLS AND ESTERS THEREOF AS ANTIATHEROSCLEROTIC AGENTS | AVENTIS PHARMA INC (US) | 2002-01-30 | — | — | EP | disclosed |
| US-5608095-A | Alkyl-4-silyl-phenols and esters thereof as antiatherosclerotic agents | HOECHST MARION ROUSSEL, INC. (US) | 1997-03-04 | — | — | US | disclosed |