Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 20/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 20/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL12879280 | 0.84 | ESR1 (0.42) | ESR1ESR2HSP90AA1 | |
| SCHEMBL2137945 | 0.79 | ESR1 (0.61) | ESR1ESR2HSP90AA1 | |
| SCHEMBL1101176 | 0.76 | ESR1 (0.45) | ESR1ESR2HSP90AA1 | |
| SCHEMBL5512412 | 0.76 | ESR1 (0.42) | ESR1ESR2HSP90AA1 | |
| SCHEMBL16230320 | 0.72 | ESR1 (0.38) | ESR1ESR2HSP90AA1 | |
| SCHEMBL1562381 | 0.72 | NQO1 (0.44) | — | |
| SCHEMBL1108353 | 0.72 | TRPA1 (0.42) | ESR1ESR2HSP90AA1 | |
| SCHEMBL14572005 | 0.72 | ALDH1A1 (0.42) | ESR1ESR2HSP90AA1 | |
| SCHEMBL8290819 | 0.69 | ESR1 (0.37) | ESR1ESR2HSP90AA1 | |
| SCHEMBL5509963 | 0.67 | AHR (0.44) | ESR1ESR2HSP90AA1 |
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-2005066143-A2 | BENZO[D]ISOXAZOL-3-OL DAAO INHIBITORS | SEPRACOR INC. (US) | 2005-07-21 | — | — | WO | disclosed |