Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.31 |
| ▸ | F2 | P00734 | 1/20 | 0.30 |
| ▸ | C1R | P00736 | 1/20 | 0.30 |
| ▸ | PLG | P00747 | 1/20 | 0.30 |
| ▸ | KLK1 | P06870 | 1/20 | 0.30 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.30 |
| ▸ | C1S | P09871 | 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 | |
|---|---|---|---|---|
| SCHEMBL5769479 | 0.76 | CYP2A6 (0.40) | — | |
| SCHEMBL28995816 | 0.76 | NISCH (0.46) | NISCH | |
| SCHEMBL13170396 | 0.76 | NISCH (0.46) | NISCH | |
| SCHEMBL12997917 | 0.76 | IDO1 (0.35) | — | |
| SCHEMBL7163648 | 0.70 | NISCH (0.39) | NISCH | |
| SCHEMBL28995691 | 0.69 | ALDH1A1 (0.49) | F2C1R | |
| SCHEMBL18849524 | 0.67 | NISCH (0.31) | NISCH | |
| SCHEMBL28995605 | 0.67 | PARP10 (0.37) | NISCH | |
| SCHEMBL1226577 | 0.67 | MEN1 (0.39) | F2C1RPLGKLK1PRSS1 | |
| SCHEMBL14236912 | 0.64 | MEN1 (0.42) | F2C1RPLGKLK1PRSS1 |
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-116057047-A | Synthesis of heterocyclic compounds from carboxamides and carboxamide derivatives and haloalkanols | 夸祖鲁-纳塔尔大学 | 2023-05-02 | — | — | CN | disclosed |