Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SHBG | P04278 | 5/20 | 0.59 |
| ▸ | ESR1 | P03372 | 9/20 | 0.56 |
| ▸ | ESR2 | Q92731 | 8/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.55 |
| ▸ | LMNA | P02545 | 4/20 | 0.55 |
| ▸ | PGR | P06401 | 4/20 | 0.55 |
| ▸ | AR | P10275 | 4/20 | 0.55 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.55 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.55 |
| ▸ | STS | P08842 | 4/20 | 0.55 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.55 |
| ▸ | SERPINA6 | P08185 | 3/20 | 0.55 |
| ▸ | SNCA | P37840 | 3/20 | 0.55 |
| ▸ | NR3C1 | P04150 | 3/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.55 |
| ▸ | HTR2B | P41595 | 3/20 | 0.55 |
| ▸ | TSHR | P16473 | 2/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL6255112 | 1.00 | SHBG (0.59) | SHBGESR1ESR2HSD17B10LMNA | |
| SCHEMBL7082645 | 0.84 | SHBG (0.62) | SHBGESR1ESR2HSD17B10LMNA | |
| SCHEMBL7147482 | 0.77 | ESR1 (0.64) | SHBGESR1ESR2HSD17B10LMNA | |
| SCHEMBL5675177 | 0.77 | ESR1 (0.64) | SHBGESR1ESR2HSD17B10LMNA | |
| SCHEMBL6256123 | 0.76 | SHBG (0.38) | SHBGESR1ESR2HSD17B10LMNA | |
| SCHEMBL6257212 | 0.76 | SHBG (0.38) | SHBGESR1ESR2HSD17B10LMNA | |
| SCHEMBL5677524 | 0.76 | ESR1 (0.65) | SHBGESR1ESR2HSD17B10LMNA | |
| SCHEMBL6256154 | 0.76 | SHBG (0.68) | SHBGESR1ESR2HSD17B10LMNA | |
| SCHEMBL5680011 | 0.76 | ESR1 (0.65) | SHBGESR1ESR2HSD17B10LMNA | |
| SCHEMBL5678022 | 0.76 | SHBG (0.68) | SHBGESR1ESR2HSD17B10LMNA |
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 1 patent. 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 | disclosed |