Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNB1 | Q14721 | 13/20 | 0.60 |
| ▸ | KCNA5 | P22460 | 6/20 | 0.59 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.59 |
| ▸ | KCNK2 | O95069 | 2/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.58 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.53 |
| ▸ | PTPN2 | P17706 | 2/20 | 0.53 |
| ▸ | PTPN6 | P29350 | 2/20 | 0.53 |
| ▸ | PTPN11 | Q06124 | 2/20 | 0.53 |
| ▸ | PTPRF | P10586 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | ESRRA | P11474 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL28402845 | 0.88 | KCNB1 (0.60) | KCNB1KCNA5KCNH2KCNK2TDP1 | |
| SCHEMBL13077332 | 0.88 | KCNB1 (0.60) | KCNB1KCNA5KCNH2KCNK2TDP1 | |
| SCHEMBL29793403 | 0.86 | KCNB1 (0.59) | KCNB1KCNA5KCNH2KCNK2TDP1 | |
| SCHEMBL28408432 | 0.85 | KCNB1 (0.50) | KCNB1KCNA5KCNH2KCNK2ALDH1A1 | |
| SCHEMBL28405957 | 0.81 | TDP1 (0.51) | KCNB1KCNA5KCNH2KCNK2TDP1 | |
| SCHEMBL28410651 | 0.80 | KCNB1 (0.78) | KCNB1KCNA5KCNH2KCNK2 | |
| SCHEMBL28403246 | 0.80 | KCNB1 (0.73) | KCNB1KCNA5KCNH2KCNK2ESRRA | |
| SCHEMBL24073972 | 0.79 | TDP1 (0.55) | TDP1PTPN1PTPN2PTPN6PTPN11 | |
| SCHEMBL28408170 | 0.78 | KCNB1 (0.81) | KCNB1KCNA5KCNH2KCNK2 | |
| SCHEMBL28402757 | 0.78 | TDP1 (0.54) | TDP1PTPN1PTPN2PTPN6PTPN11 |
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 |