Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 9/20 | 0.52 |
| ▸ | ESR2 | Q92731 | 9/20 | 0.52 |
| ▸ | SHBG | P04278 | 5/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.52 |
| ▸ | LMNA | P02545 | 4/20 | 0.52 |
| ▸ | STS | P08842 | 4/20 | 0.52 |
| ▸ | PGR | P06401 | 4/20 | 0.52 |
| ▸ | AR | P10275 | 4/20 | 0.52 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.52 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.52 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.52 |
| ▸ | SERPINA6 | P08185 | 3/20 | 0.52 |
| ▸ | SNCA | P37840 | 3/20 | 0.52 |
| ▸ | HTR2B | P41595 | 3/20 | 0.52 |
| ▸ | NR3C1 | P04150 | 3/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.52 |
| ▸ | AKR1B10 | O60218 | 2/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL259537 | 1.00 | ESR1 (0.52) | ESR1ESR2SHBGHSD17B10LMNA | |
| SCHEMBL8959365 | 1.00 | ESR1 (0.52) | ESR1ESR2SHBGHSD17B10LMNA | |
| SCHEMBL8959381 | 1.00 | ESR1 (0.52) | ESR1ESR2SHBGHSD17B10LMNA | |
| SCHEMBL9725110 | 0.90 | ESR1 (0.48) | ESR1ESR2SHBGHSD17B10LMNA | |
| SCHEMBL9725182 | 0.90 | ESR1 (0.48) | ESR1ESR2SHBGHSD17B10LMNA | |
| SCHEMBL8959377 | 0.87 | LMNA (0.55) | ESR1ESR2HSD17B10LMNASTS | |
| SCHEMBL8959370 | 0.87 | LMNA (0.55) | ESR1ESR2HSD17B10LMNASTS | |
| SCHEMBL9148144 | 0.87 | LMNA (0.55) | ESR1ESR2HSD17B10LMNASTS | |
| SCHEMBL9725143 | 0.86 | ESR1 (0.49) | ESR1ESR2SHBGHSD17B10LMNA | |
| SCHEMBL9144814 | 0.83 | LMNA (0.58) | ESR1SHBGHSD17B10LMNASTS |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0513947-B1 | 14 Alpha, 16alpha-ethano- and 14alpha, 16alpha ethenoestratrienes | SCHERING AG (DE) | 1995-11-15 | — | — | EP | disclosed |
| US-5439902-A | Estrogen therapy, birth control | SCHERING AKTIENGESELLSCHAFT (DE) | 1995-08-08 | — | — | US | disclosed |
| EP-0513947-A1 | 14 Alpha, 16alpha-ethano- and 14alpha, 16alpha ethenoestratrienes | SCHERING AKTIENGESELLSCHAFT (DE) | 1992-11-19 | — | — | EP | disclosed |