Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 3/20 | 0.50 |
| ▸ | APP | P05067 | 2/20 | 0.50 |
| ▸ | LTA4H | P09960 | 2/20 | 0.50 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 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 | 0.86 | ESR2 (0.50) | ESR2APPLTA4HCALM1GAA | |
| SCHEMBL7516141 | 0.77 | CA2 (0.54) | CALM1GAAMEN1KMT2AMAPT | |
| Mequinol SCHEMBL27365765 | 0.77 | ESR2 (0.80) | ESR2APPLTA4HCALM1GAA | |
| SCHEMBL24845052 | 0.75 | LTA4H (0.64) | ESR2APPLTA4HCALM1GAA | |
| SCHEMBL28279511 | 0.75 | LTA4H (0.64) | ESR2APPLTA4HCALM1GAA | |
| SCHEMBL8443089 | 0.75 | LTA4H (0.52) | ESR2APPLTA4HMEN1KMT2A | |
| Mequinol SCHEMBL166535 | 0.74 | ESR2 (0.84) | ESR2APPLTA4HCALM1GAA | |
| Mequinol SCHEMBL1535640 | 0.74 | ESR2 (0.84) | ESR2APPLTA4HCALM1GAA | |
| Mequinol SCHEMBL21009 | 0.74 | — | — | |
| 1,4-Dimethoxybenzene SCHEMBL8351066 | 0.74 | ESR2 (0.84) | ESR2APPLTA4HCALM1GAA |
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 |