Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 2/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | CA3 | P07451 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | CA6 | P23280 | 1/20 | 0.43 |
| ▸ | CASP1 | P29466 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 3/20 | 0.42 |
| ▸ | LTA4H | P09960 | 3/20 | 0.41 |
| ▸ | APP | P05067 | 2/20 | 0.40 |
| ▸ | MAOB | P27338 | 4/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8374301 | 0.85 | ESR2 (0.50) | ALDH1A1ESR1ESR2GAALTA4H | |
| SCHEMBL8887466 | 0.83 | CYP1A2 (0.42) | ALDH1A1HSD17B10LTA4HAPPMAOB | |
| SCHEMBL8444609 | 0.83 | LMNA (0.52) | HIF1AESR1CYP19A1ESR2GAA | |
| SCHEMBL7520674 | 0.77 | NR1H4 (0.52) | ALDH1A1ALOX15HSD17B10GAAMAPT | |
| SCHEMBL8443089 | 0.74 | LTA4H (0.52) | HIF1AESR1ESR2LTA4HAPP | |
| SCHEMBL12660720 | 0.74 | TDP1 (0.58) | TDP1TSHRALDH1A1CYP3A4HSD17B10 | |
| SCHEMBL6054922 | 0.72 | CA2 (0.45) | TDP1TSHRHIF1AALDH1A1CYP3A4 | |
| SCHEMBL8518289 | 0.71 | ESR2 (0.50) | ALDH1A1ESR1ESR2GAALTA4H | |
| SCHEMBL2194744 | 0.71 | TDP1 (0.54) | TDP1TSHRALDH1A1CYP3A4HSD17B10 | |
| SCHEMBL7517793 | 0.70 | TSHR (0.34) | TSHRCASP1ESR1ESR2 |
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-A1 | ALKYL-4-SILYL-PHENOLS AND ESTERS THEREOF AS ANTIATHEROSCLEROTIC AGENTS | HOECHST MARION ROUSSEL, INC. (US) | 1999-03-10 | — | — | EP | disclosed |
| WO-1997041129-A1 | ALKYL-4-SILYL-PHENOLS AND ESTERS THEREOF AS ANTIATHEROSCLEROTIC AGENTS | HOECHST MARION ROUSSEL, INC. (US) | 1997-11-06 | — | — | WO | disclosed |