Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA3 | P07451 | 1/20 | 0.32 |
| ▸ | CA4 | P22748 | 1/20 | 0.32 |
| ▸ | CA6 | P23280 | 1/20 | 0.32 |
| ▸ | CA5A | P35218 | 1/20 | 0.32 |
| ▸ | CA7 | P43166 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.32 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.32 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | BUB1 | O43683 | 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 | |
|---|---|---|---|---|
| SCHEMBL3831855 | 0.69 | CA12 (0.33) | CA12CA1CA3CA4CA6 | |
| SCHEMBL8559806 | 0.69 | — | — | |
| SCHEMBL7421619 | 0.68 | PDE4A (0.30) | — | |
| SCHEMBL12333775 | 0.65 | EZH2 (0.31) | — | |
| SCHEMBL4335213 | 0.64 | CA12 (0.32) | CA12CA1CA3CA4CA6 | |
| SCHEMBL8661024 | 0.63 | ALDH1A1 (0.31) | ALDH1A1 | |
| SCHEMBL13653521 | 0.63 | ALDH1A1 (0.33) | ALDH1A1 | |
| SCHEMBL22525942 | 0.62 | — | — | |
| SCHEMBL21023124 | 0.62 | — | — | |
| SCHEMBL9097365 | 0.62 | CA12 (0.31) | CA12CA1CA3CA4CA6 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115385912-A | Pyrazinopyrazinoquinolinone derivatives, preparation method and medical application thereof | 浙江海正药业股份有限公司 | 2022-11-25 | — | — | CN | disclosed |
| CN-103724372-B | The purposes of ethylene alkyl phosphinic acid, ethylene alkyl phosphinates and ethylene alkyl phosphinate | 科莱恩金融(BVI)有限公司 | 2017-03-01 | — | — | CN | disclosed |
| CN-101052399-A | Chemical compounds | SMITHKLINE BEECHAM CORP (US) | 2007-10-10 | — | — | CN | disclosed |
| WO-2002014465-A2 | MULTICYCLIC AROMATIC COMPOUNDS AND USES THEREOF | ROCHE DIAGNOSTICS CORPORATION (US) | 2002-02-21 | — | — | WO | disclosed |
| EP-0022078-B1 | PYRAZOLO-QUINOLINES, PROCESSES FOR THEIR PRODUCTION, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | CIBA-GEIGY AG (CH) | 1984-07-25 | — | — | EP | disclosed |