Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.48 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL22834514 | 0.83 | — | — | |
| SCHEMBL26984591 | 0.81 | — | — | |
| SCHEMBL23603996 | 0.80 | ESR1 (0.48) | ESR1ESR2 | |
| SCHEMBL12687548 | 0.80 | — | — | |
| SCHEMBL15680666 | 0.78 | — | — | |
| SCHEMBL12064525 | 0.78 | — | — | |
| SCHEMBL26721931 | 0.77 | — | — | |
| SCHEMBL26721949 | 0.77 | ESR1 (0.36) | ESR1ESR2TSHR | |
| SCHEMBL23832316 | 0.75 | ESR1 (0.39) | ESR1ESR2TSHR | |
| SCHEMBL16309022 | 0.75 | TSHR (0.44) | ESR1ESR2TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-3704114-A1 | SPIROCYCLIC COMPOUNDS AS FARNESOID X RECEPTOR MODULATORS | Bristol-Myers Squibb Company (US) | 2020-09-09 | — | — | EP | disclosed |