Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | METTL3 | Q86U44 | 4/20 | 0.42 |
| ▸ | XDH | P47989 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | BRD4 | O60885 | 2/20 | 0.41 |
| ▸ | NAMPT | P43490 | 2/20 | 0.41 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.41 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.41 |
| ▸ | ATR | Q13535 | 1/20 | 0.40 |
| ▸ | AURKA | O14965 | 1/20 | 0.39 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL25882485 | 1.00 | L3MBTL1 (0.44) | L3MBTL1HDAC1METTL3XDHCA12 | |
| SCHEMBL25882848 | 0.84 | PI4KA (0.55) | L3MBTL1HDAC1CA12CA1CA2 | |
| SCHEMBL25312468 | 0.83 | MKNK2 (0.46) | METTL3XDHCA1CA2CA9 | |
| SCHEMBL25883691 | 0.78 | METTL3 (0.52) | METTL3XDHMKNK2 | |
| SCHEMBL25882543 | 0.78 | METTL3 (0.40) | METTL3XDHMKNK2 | |
| SCHEMBL21272867 | 0.77 | DGAT1 (0.45) | L3MBTL1NAMPT | |
| SCHEMBL25882514 | 0.74 | MKNK2 (0.49) | METTL3XDHMKNK2 | |
| SCHEMBL31186246 | 0.73 | BTK (0.42) | L3MBTL1HDAC1BRD4NAMPT | |
| SCHEMBL21528214 | 0.73 | BTK (0.42) | L3MBTL1HDAC1BRD4NAMPT | |
| SCHEMBL24804917 | 0.73 | L3MBTL1 (0.45) | L3MBTL1HDAC1BRD4NAMPT |
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-2022057787-A1 | PROGRAMMED CELL NECROSIS INHIBITOR, PREPARATION METHOD THEREFOR, AND USE THEREOF | 中国科学院上海有机化学研究所 | 2022-03-24 | — | — | WO | disclosed |