Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 13/20 | 1.00 |
| ▸ | ESR2 | Q92731 | 13/20 | 1.00 |
| ▸ | TYR | P14679 | 2/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.31 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.31 |
| ▸ | MAOA | P21397 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6825390 | 0.83 | ESR1 (1.00) | ESR1ESR2TYRMAOA | |
| SCHEMBL6828067 | 0.78 | ESR1 (1.00) | ESR1ESR2TYRALOX5 | |
| SCHEMBL6825238 | 0.73 | ESR1 (1.00) | ESR1ESR2TYRMAOA | |
| SCHEMBL6830345 | 0.66 | ESR1 (1.00) | ESR1ESR2 | |
| SCHEMBL6828658 | 0.65 | ESR1 (1.00) | ESR1ESR2TYR | |
| SCHEMBL6825526 | 0.65 | ESR2 (0.64) | ESR1ESR2MAOA | |
| SCHEMBL28417820 | 0.65 | ESR2 (0.65) | ESR1ESR2TYR | |
| SCHEMBL6827956 | 0.61 | ESR1 (1.00) | ESR1ESR2TYR | |
| SCHEMBL6830103 | 0.59 | ESR1 (1.00) | ESR1ESR2 | |
| SCHEMBL13335379 | 0.59 | ESR1 (0.46) | ESR1ESR2TYR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004073612-A2 | ESTROGEN RECEPTOR MODULATORS | MERCK & CO. INC. (US) | 2004-09-02 | — | — | WO | claimed |
| WO-2004073612-A2 | ESTROGEN RECEPTOR MODULATORS | MERCK & CO. INC. (US) | 2004-09-02 | — | — | WO | disclosed |