Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK1 | Q15118 | 2/20 | 0.36 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.36 |
| ▸ | PDK3 | Q15120 | 2/20 | 0.36 |
| ▸ | PDK4 | Q16654 | 2/20 | 0.36 |
| ▸ | ESR1 | P03372 | 9/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 6/20 | 0.35 |
| ▸ | LMNA | P02545 | 5/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | SLC22A1 | O15245 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | SHBG | P04278 | 2/20 | 0.35 |
| ▸ | SERPINA6 | P08185 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | G6PD | P11413 | 2/20 | 0.35 |
| ▸ | PKM | P14618 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL20048225 | 0.90 | ESR1 (0.37) | PDK1PDK2PDK3PDK4ESR1 | |
| SCHEMBL20048226 | 0.90 | ESR1 (0.37) | PDK1PDK2PDK3PDK4ESR1 | |
| SCHEMBL21143415 | 0.90 | ESR1 (0.37) | PDK1PDK2PDK3PDK4ESR1 | |
| SCHEMBL8539498 | 0.88 | PDK1 (0.37) | PDK1PDK2PDK3PDK4ESR1 | |
| SCHEMBL22861582 | 0.88 | PGR (0.41) | PDK1PDK2PDK3PDK4ESR1 | |
| SCHEMBL9019762 | 0.88 | PGR (0.41) | PDK1PDK2PDK3PDK4ESR1 | |
| SCHEMBL23131064 | 0.86 | PGR (0.43) | PDK1PDK2PDK3PDK4ESR1 | |
| SCHEMBL20048080 | 0.86 | PGR (0.43) | PDK1PDK2PDK3PDK4ESR1 | |
| SCHEMBL20048097 | 0.86 | PDK1 (0.34) | PDK1PDK2PDK3PDK4ESR1 | |
| SCHEMBL20048083 | 0.86 | PGR (0.43) | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| 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 |