Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.45 |
| ▸ | CA2 | P00918 | 2/20 | 0.45 |
| ▸ | CA7 | P43166 | 2/20 | 0.45 |
| ▸ | CA9 | Q16790 | 2/20 | 0.45 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.45 |
| ▸ | PPARD | Q03181 | 11/20 | 0.43 |
| ▸ | PPARA | Q07869 | 2/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL27913921 | 0.88 | CA1 (0.46) | CA1CA2CA7CA9CA14 | |
| SCHEMBL28314190 | 0.79 | MAOA (0.49) | HRH3 | |
| SCHEMBL17732716 | 0.78 | CA1 (0.55) | CA1CA2CA7CA9CA14 | |
| SCHEMBL17732708 | 0.78 | CA1 (0.55) | CA1CA2CA7CA9CA14 | |
| SCHEMBL17732726 | 0.78 | CA1 (0.55) | CA1CA2CA7CA9CA14 | |
| SCHEMBL27913698 | 0.78 | HRH3 (0.39) | CA1CA2CA7CA9CA14 | |
| SCHEMBL27896291 | 0.77 | HRH3 (0.38) | CA1CA2CA7CA9CA14 | |
| SCHEMBL28823734 | 0.75 | CA1 (0.50) | CA1CA2CA7CA9CA14 | |
| SCHEMBL28770047 | 0.75 | ADRA2A (0.41) | CA1CA2CA7CA9CA14 | |
| SCHEMBL17732769 | 0.72 | KDM1A (0.43) | CA1CA2CA7CA9CA14 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102482234-B | Nitrogen-containing compounds and pharmaceutical compositions thereof for the treatment of atrial fibrillation | OTSUKA PHARMACEUTICAL CO.,LTD. (JP) | 2016-04-13 | — | — | CN | disclosed |