Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.52 |
| ▸ | CA2 | P00918 | 1/20 | 0.52 |
| ▸ | CA9 | Q16790 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL21537072 | 0.81 | CA1 (0.48) | CA1CA2CA9 | |
| SCHEMBL26912 | 0.79 | CA2 (0.56) | CA1CA2CA9HTT | |
| SCHEMBL21279961 | 0.76 | CA1 (0.48) | CA1CA2CA9 | |
| SCHEMBL775983 | 0.75 | CA1 (0.65) | CA1CA2CA9HTT | |
| SCHEMBL972507 | 0.75 | CA1 (0.52) | CA1CA2CA9HTT | |
| SCHEMBL777502 | 0.75 | CA1 (0.52) | CA1CA2CA9HTT | |
| SCHEMBL591023 | 0.75 | TSHR (0.46) | CA1CA2CA9 | |
| SCHEMBL575356 | 0.75 | TSHR (0.40) | CA1CA2CA9 | |
| SCHEMBL55106 | 0.75 | CA1 (0.52) | CA1CA2CA9HTT | |
| SCHEMBL22182911 | 0.75 | CA1 (0.46) | CA1CA2CA9 |
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-2023132369-A1 | NITROGEN-CONTAINING HETEROCYCLIC COMPOUND HAVING NRF2 ACTIVATION EFFECT | 中外製薬株式会社 | 2023-07-13 | — | — | WO | disclosed |