Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNB1 | Q14721 | 18/20 | 1.00 |
| ▸ | KCNA5 | P22460 | 6/20 | 0.82 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.82 |
| ▸ | KCNK2 | O95069 | 2/20 | 0.82 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.56 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL29793595 | 0.90 | KCNB1 (1.00) | KCNB1KCNA5KCNH2KCNK2 | |
| SCHEMBL28411048 | 0.90 | KCNB1 (1.00) | KCNB1KCNA5KCNH2KCNK2 | |
| SCHEMBL28408137 | 0.88 | KCNB1 (0.79) | KCNB1KCNA5KCNH2KCNK2 | |
| SCHEMBL28408170 | 0.88 | KCNB1 (0.81) | KCNB1KCNA5KCNH2KCNK2 | |
| SCHEMBL28410651 | 0.87 | KCNB1 (0.78) | KCNB1KCNA5KCNH2KCNK2 | |
| SCHEMBL28406241 | 0.87 | KCNB1 (0.85) | KCNB1KCNA5KCNH2KCNK2 | |
| SCHEMBL29793632 | 0.87 | KCNB1 (0.80) | KCNB1KCNA5KCNH2KCNK2 | |
| SCHEMBL28406310 | 0.87 | KCNB1 (1.00) | KCNB1KCNA5KCNH2KCNK2 | |
| SCHEMBL29793609 | 0.87 | KCNB1 (0.80) | KCNB1KCNA5KCNH2KCNK2 | |
| SCHEMBL28411365 | 0.87 | KCNB1 (0.80) | KCNB1KCNA5KCNH2KCNK2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108929263-B | Arylamide Kv2.1 inhibitor and preparation method, pharmaceutical composition and application thereof | 中国医学科学院药物研究所 | 2022-07-22 | — | — | CN | disclosed |
| CN-111108092-A | Arylamide Kv2.1 inhibitor and preparation method, pharmaceutical composition and application thereof | 中国医学科学院药物研究所 | 2020-05-05 | — | — | CN | disclosed |