Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SHBG | P04278 | 1/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | DAO | P14920 | 3/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.30 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.30 |
| ▸ | DDO | Q99489 | 1/20 | 0.30 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | ESR1 | P03372 | 1/20 | 0.30 |
| ▸ | ESR2 | Q92731 | 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 | |
|---|---|---|---|---|
| SCHEMBL7521986 | 0.89 | HMGCR (0.33) | TRPA1ATMESR1ESR2 | |
| SCHEMBL7515184 | 0.86 | TYR (0.38) | TRPA1ATMMCL1TP53MAPT | |
| SCHEMBL27515458 | 0.82 | ESR1 (0.34) | SHBGTRPA1ATMDAOGABRA1 | |
| SCHEMBL7526769 | 0.79 | TRPA1 (0.37) | TRPA1ATMTP53GAAMAPT | |
| SCHEMBL7520590 | 0.78 | GABRA1 (0.30) | GABRA1GABRB2ESR1ESR2 | |
| SCHEMBL8441767 | 0.78 | TRPA1 (0.43) | TRPA1ATMTP53GAAMAPT | |
| SCHEMBL7520566 | 0.73 | LMNA (0.34) | TRPA1ATMTP53GAAMAPT | |
| SCHEMBL27496914 | 0.72 | ALOX5 (0.34) | TRPA1ATMTP53GAAMAPT | |
| SCHEMBL8379346 | 0.72 | TRPA1 (0.33) | TRPA1ATM | |
| SCHEMBL7525374 | 0.71 | ALDH1A1 (0.36) | TRPA1ATMGABRA1GABRB2TP53 |
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 |