Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 3/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.37 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.31 |
| ▸ | NR1H3 | Q13133 | 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 | |
|---|---|---|---|---|
| SCHEMBL12409056 | 0.79 | ALDH1A1 (0.42) | ESR1ESR2NR1H2NR1H3 | |
| SCHEMBL2444202 | 0.79 | NR1H2 (0.31) | NR1H2NR1H3 | |
| SCHEMBL9616600 | 0.78 | CNR2 (0.45) | ESR1ESR2 | |
| SCHEMBL17133881 | 0.77 | — | — | |
| SCHEMBL23578339 | 0.76 | ESR1 (0.41) | ESR1ESR2NR1H2NR1H3 | |
| SCHEMBL23588065 | 0.76 | KIF11 (0.47) | ESR1ESR2 | |
| SCHEMBL16933755 | 0.73 | ALDH1A1 (0.41) | — | |
| SCHEMBL29029269 | 0.73 | ESR1 (0.35) | ESR1ESR2 | |
| SCHEMBL2798326 | 0.73 | NR1H2 (0.36) | ESR1ESR2NR1H2NR1H3 | |
| SCHEMBL23578307 | 0.73 | ESR1 (0.36) | ESR1ESR2NR1H2NR1H3 |
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-1992018092-A2 | 1-ARYLHETEROARYLALKYL SUBSTITUTED-1H-1,2,4-TRIAZOLE COMPOUNDS FOR TREATMENT OF CIRCULATORY DISORDERS | G.D. SEARLE & CO. (US) | 1992-10-29 | — | — | WO | claimed |