Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK1 | Q15118 | 2/20 | 0.37 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.37 |
| ▸ | PDK3 | Q15120 | 2/20 | 0.37 |
| ▸ | PDK4 | Q16654 | 2/20 | 0.37 |
| ▸ | ESR1 | P03372 | 10/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 7/20 | 0.34 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | SLC22A1 | O15245 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | SHBG | P04278 | 2/20 | 0.34 |
| ▸ | SERPINA6 | P08185 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL20048226 | 0.89 | ESR1 (0.37) | PDK1PDK2PDK3PDK4ESR1 | |
| SCHEMBL21143415 | 0.89 | ESR1 (0.37) | PDK1PDK2PDK3PDK4ESR1 | |
| SCHEMBL20048225 | 0.89 | ESR1 (0.37) | PDK1PDK2PDK3PDK4ESR1 | |
| SCHEMBL23131064 | 0.89 | PGR (0.43) | PDK1PDK2PDK3PDK4ESR1 | |
| SCHEMBL20048083 | 0.89 | PGR (0.43) | PDK1PDK2PDK3PDK4ESR1 | |
| SCHEMBL20048080 | 0.89 | PGR (0.43) | PDK1PDK2PDK3PDK4ESR1 | |
| SCHEMBL9019868 | 0.88 | PDK1 (0.36) | PDK1PDK2PDK3PDK4ESR1 | |
| SCHEMBL9019762 | 0.87 | PGR (0.41) | PDK1PDK2PDK3PDK4ESR1 | |
| SCHEMBL22861582 | 0.87 | PGR (0.41) | PDK1PDK2PDK3PDK4ESR1 | |
| SCHEMBL21143403 | 0.86 | PDK1 (0.39) | PDK1PDK2PDK3PDK4ESR1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5843933-A | 11β-aryl-4-estrenes, process for their production as well as their use as pharmaceutical agents | SCHERING AKTIENGESELLSCHAFT (DE) | 1998-12-01 | — | — | US | disclosed |
| US-5728689-A | ANTIGESTAGENIC EFFECT | SCHERING AKTIENGESELLSCHAFT (DE) | 1998-03-17 | — | — | US | disclosed |
| EP-0404283-B1 | 11-Beta-aryl-4-estrene, method for its production and its use as a medicine | SCHERING AG (DE) | 1996-05-08 | — | — | EP | disclosed |
| EP-0404283-A2 | 11-Beta-aryl-4-estrene, method for its production and its use as a medicine | SCHERING AKTIENGESELLSCHAFT (DE) | 1990-12-27 | — | — | EP | disclosed |