Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 5/20 | 0.67 |
| ▸ | AURKB | Q96GD4 | 4/20 | 0.67 |
| ▸ | PARP1 | P09874 | 2/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.57 |
| ▸ | MEN1 | O00255 | 1/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.57 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.56 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.56 |
| ▸ | SIRT2 | Q8IXJ6 | 3/20 | 0.56 |
| ▸ | RPS6KB1 | P23443 | 4/20 | 0.55 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.55 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.54 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL30802649 | 1.00 | AURKA (0.67) | AURKAAURKBPARP1KDM4EMEN1 | |
| SCHEMBL29200341 | 0.90 | PARP1 (0.67) | AURKAAURKBPARP1KDM4EMEN1 | |
| SCHEMBL30802632 | 0.90 | PARP1 (0.67) | AURKAAURKBPARP1KDM4EMEN1 | |
| SCHEMBL30802613 | 0.87 | MEN1 (0.75) | AURKAAURKBPARP1KDM4EMEN1 | |
| SCHEMBL29200319 | 0.87 | MEN1 (0.75) | AURKAAURKBPARP1KDM4EMEN1 | |
| SCHEMBL29200350 | 0.87 | PARP1 (0.78) | AURKAAURKBPARP1MEN1KMT2A | |
| SCHEMBL29200346 | 0.85 | PARP1 (0.65) | AURKAAURKBPARP1KDM4EMEN1 | |
| SCHEMBL30802655 | 0.85 | PARP1 (0.65) | AURKAAURKBPARP1KDM4EMEN1 | |
| SCHEMBL29200358 | 0.83 | PARP1 (0.72) | AURKAAURKBPARP1MEN1KMT2A | |
| SCHEMBL666202 | 0.80 | AURKA (1.00) | AURKAAURKBRPS6KB1PDPK1 |
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-117658868-A | Benzamide derivative and preparation method and application thereof | 中山大学 | 2024-03-08 | — | — | CN | claimed |
| CN-117658868-A | Benzamide derivative and preparation method and application thereof | 中山大学 | 2024-03-08 | — | — | CN | disclosed |