Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.40 |
| ▸ | ESR1 | P03372 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6227825 | 1.00 | HSD11B1 (0.41) | HSD11B1ESR2ESR1 | |
| SCHEMBL4588592 | 1.00 | HSD11B1 (0.41) | HSD11B1ESR2ESR1 | |
| SCHEMBL4588595 | 1.00 | HSD11B1 (0.41) | HSD11B1ESR2ESR1 | |
| SCHEMBL4587813 | 0.83 | HSD11B1 (0.44) | HSD11B1ESR2ESR1 | |
| SCHEMBL4587816 | 0.83 | HSD11B1 (0.44) | HSD11B1ESR2ESR1 | |
| SCHEMBL4588166 | 0.83 | HSD11B1 (0.41) | HSD11B1ESR2ESR1 | |
| SCHEMBL4588161 | 0.83 | HSD11B1 (0.41) | HSD11B1ESR2ESR1 | |
| SCHEMBL4589265 | 0.79 | HSD11B1 (0.40) | HSD11B1ESR2ESR1 | |
| SCHEMBL4590174 | 0.76 | HSD11B1 (0.64) | HSD11B1ESR2ESR1 | |
| SCHEMBL3649589 | 0.65 | HSD11B1 (0.78) | HSD11B1ESR1 |
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-1517914-A2 | 9-ALPHA-SUBSTITUTED ESTRATRIENES AS SELECTIVELY ACTIVE ESTROGEN | Schering Aktiengesellschaft (DE) | 2005-03-30 | — | — | EP | disclosed |
| WO-2003104253-A2 | 9-ALPHA-SUBSTITUTED ESTRATRIENES AS SELECTIVELY ACTIVE ESTROGEN | SCHERING AKTIENGESELLSCHAFT (DE) | 2003-12-18 | — | — | WO | disclosed |