Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 6/20 | 0.56 |
| ▸ | RPS6KB1 | P23443 | 5/20 | 0.56 |
| ▸ | TOP2A | P11388 | 1/20 | 0.48 |
| ▸ | TOP2B | Q02880 | 1/20 | 0.48 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.47 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.42 |
| ▸ | BRD4 | O60885 | 3/20 | 0.42 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | MET | P08581 | 1/20 | 0.40 |
| ▸ | SYK | P43405 | 1/20 | 0.40 |
| ▸ | GRM5 | P41594 | 1/20 | 0.40 |
| ▸ | PDE4B | Q07343 | 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 | |
|---|---|---|---|---|
| SCHEMBL29947712 | 1.00 | AURKA (0.56) | AURKARPS6KB1TOP2ATOP2BTLR7 | |
| SCHEMBL29947681 | 0.89 | AURKA (0.53) | AURKARPS6KB1TOP2ATOP2BMAP4K4 | |
| SCHEMBL29136655 | 0.89 | AURKA (0.53) | AURKARPS6KB1TOP2ATOP2BMAP4K4 | |
| SCHEMBL29947745 | 0.85 | AURKA (0.51) | AURKARPS6KB1TOP2ATOP2BTLR7 | |
| SCHEMBL29136627 | 0.85 | AURKA (0.51) | AURKARPS6KB1TOP2ATOP2BTLR7 | |
| SCHEMBL26981109 | 0.85 | AURKA (0.45) | AURKARPS6KB1TOP2ATOP2BAURKB | |
| SCHEMBL29136642 | 0.84 | HDAC1 (0.48) | AURKARPS6KB1BRD4MEN1NPC1 | |
| SCHEMBL29947676 | 0.84 | HDAC1 (0.48) | AURKARPS6KB1BRD4MEN1NPC1 | |
| SCHEMBL29136626 | 0.82 | AURKA (0.48) | AURKARPS6KB1TOP2ATOP2BTLR7 | |
| SCHEMBL29947592 | 0.82 | AURKA (0.48) | AURKARPS6KB1TOP2ATOP2BTLR7 |
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-117355341-A | TLR7 and TLR8 agonists for the treatment of cancer and/or infectious diseases | 纽约州立大学研究基金会 | 2024-01-05 | — | — | CN | disclosed |