Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C1 | P04150 | 12/20 | 0.45 |
| ▸ | ESR1 | P03372 | 5/20 | 0.45 |
| ▸ | ESR2 | Q92731 | 5/20 | 0.45 |
| ▸ | PGR | P06401 | 3/20 | 0.45 |
| ▸ | AR | P10275 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | SHBG | P04278 | 1/20 | 0.36 |
| ▸ | SERPINA6 | P08185 | 1/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | SNCA | P37840 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.36 |
| ▸ | UGT1A10 | Q9HAW8 | 1/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.33 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4588410 | 0.94 | NR3C1 (0.49) | NR3C1ESR1ESR2PGRAR | |
| SCHEMBL6027234 | 0.91 | ESR1 (0.44) | NR3C1ESR1ESR2PGRAR | |
| SCHEMBL6028199 | 0.91 | ESR1 (0.44) | NR3C1ESR1ESR2PGRAR | |
| SCHEMBL1829051 | 0.91 | ESR1 (0.44) | NR3C1ESR1ESR2PGRAR | |
| SCHEMBL12513381 | 0.82 | NR3C1 (0.50) | NR3C1ESR1ESR2PGRAR | |
| SCHEMBL4587569 | 0.81 | ESR1 (0.44) | NR3C1ESR1ESR2PGRAR | |
| SCHEMBL4587563 | 0.81 | ESR1 (0.44) | NR3C1ESR1ESR2PGRAR | |
| SCHEMBL4589474 | 0.75 | NR3C1 (0.53) | NR3C1ESR1ESR2PGRAR | |
| SCHEMBL4588414 | 0.72 | ESR1 (0.41) | NR3C1ESR1ESR2PGRAR | |
| SCHEMBL6232274 | 0.72 | ESR1 (0.37) | NR3C1ESR1ESR2PGRLMNA |
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-1517914-B1 | 9-ALPHA-SUBSTITUTED ESTRATRIENES AS SELECTIVELY ACTIVE ESTROGEN | SCHERING AG (DE) | 2005-08-31 | — | — | EP | claimed |