Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 7/20 | 0.49 |
| ▸ | ESR2 | Q92731 | 6/20 | 0.49 |
| ▸ | NR3C1 | P04150 | 5/20 | 0.48 |
| ▸ | SOD1 | P00441 | 1/20 | 0.42 |
| ▸ | STS | P08842 | 2/20 | 0.41 |
| ▸ | SHBG | P04278 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | PGR | P06401 | 2/20 | 0.40 |
| ▸ | SERPINA6 | P08185 | 2/20 | 0.40 |
| ▸ | AR | P10275 | 2/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.40 |
| ▸ | SNCA | P37840 | 2/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.40 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | HSD17B1 | P14061 | 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 | |
|---|---|---|---|---|
| SCHEMBL5682088 | 1.00 | ESR1 (0.49) | ESR1ESR2NR3C1SOD1STS | |
| SCHEMBL5677972 | 0.85 | ESR1 (0.47) | ESR1ESR2NR3C1SOD1STS | |
| SCHEMBL6260433 | 0.85 | ESR1 (0.47) | ESR1ESR2NR3C1SOD1STS | |
| SCHEMBL4623201 | 0.84 | SRD5A1 (0.40) | STSLMNAHTR2B | |
| SCHEMBL4587931 | 0.83 | ESR2 (0.55) | ESR1ESR2NR3C1SHBGLMNA | |
| SCHEMBL1829950 | 0.83 | NR3C1 (0.41) | ESR1ESR2NR3C1SOD1STS | |
| SCHEMBL6232522 | 0.83 | NR3C1 (0.41) | ESR1ESR2NR3C1SOD1STS | |
| SCHEMBL4587414 | 0.83 | NR3C1 (0.41) | ESR1ESR2NR3C1SOD1STS | |
| SCHEMBL6233082 | 0.83 | NR3C1 (0.41) | ESR1ESR2NR3C1SOD1STS | |
| SCHEMBL4587411 | 0.83 | NR3C1 (0.41) | ESR1ESR2NR3C1SOD1STS |
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-1580192-A2 | 16-Hydroxyestratrienes as selective estrogens | Schering AG (DE) | 2005-09-28 | — | — | EP | claimed |
| EP-1580192-A2 | 16-Hydroxyestratrienes as selective estrogens | Schering AG (DE) | 2005-09-28 | — | — | EP | disclosed |