Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SHBG | P04278 | 2/20 | 0.47 |
| ▸ | SERPINA6 | P08185 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.47 |
| ▸ | THRB | P10828 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 6/20 | 0.46 |
| ▸ | PGR | P06401 | 5/20 | 0.46 |
| ▸ | AR | P10275 | 4/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | ESR1 | P03372 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.44 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL13770128 | 0.84 | AR (0.46) | SHBGSERPINA6ALDH1A1SLC22A1THRB | |
| SCHEMBL13474778 | 0.79 | AR (0.45) | SHBGSERPINA6ALDH1A1SLC22A1THRB | |
| SCHEMBL13770350 | 0.78 | CYP19A1 (0.54) | SHBGSERPINA6ALDH1A1SLC22A1THRB | |
| SCHEMBL13769023 | 0.74 | PGR (0.43) | SHBGSERPINA6ALDH1A1SLC22A1THRB | |
| SCHEMBL11646807 | 0.71 | PGR (0.66) | SHBGSERPINA6ALDH1A1SLC22A1THRB | |
| SCHEMBL13556656 | 0.71 | SHBG (0.44) | SHBGSERPINA6ALDH1A1SLC22A1THRB | |
| SCHEMBL13770470 | 0.71 | CYP19A1 (0.56) | SHBGSERPINA6ALDH1A1SLC22A1THRB | |
| SCHEMBL11865677 | 0.69 | SHBG (0.63) | SHBGSERPINA6ALDH1A1SLC22A1THRB | |
| SCHEMBL11855930 | 0.69 | SHBG (0.66) | SHBGSERPINA6ALDH1A1SLC22A1THRB | |
| SCHEMBL11866860 | 0.69 | SHBG (0.62) | SHBGSERPINA6ALDH1A1SLC22A1THRB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009083268-A2 | 17-(1'-PROPENYL)-17-3'-OXIDOESTRA-4-EN-3-ONE DERIVATIVE, USE THEREOF, AND MEDICAMENT CONTAINING SAID DERIVATIVE | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2009-07-09 | — | — | WO | disclosed |