Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE9A | O76083 | 2/20 | 0.33 |
| ▸ | FEN1 | P39748 | 2/20 | 0.32 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.32 |
| ▸ | IDO1 | P14902 | 1/20 | 0.31 |
| ▸ | TDO2 | P48775 | 1/20 | 0.31 |
| ▸ | ACVRL1 | P37023 | 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 | |
|---|---|---|---|---|
| SCHEMBL31392172 | 0.78 | IDO1 (0.36) | PDE9AIDO1TDO2 | |
| SCHEMBL29902105 | 0.77 | ADRA2A (0.35) | PDE9A | |
| SCHEMBL3297238 | 0.71 | PYGL (0.34) | PDE9A | |
| SCHEMBL3513238 | 0.70 | APLNR (0.35) | FEN1ALOX5AP | |
| SCHEMBL25160321 | 0.69 | CCR1 (0.39) | IDO1TDO2 | |
| SCHEMBL29907417 | 0.69 | IDO1 (0.36) | IDO1 | |
| SCHEMBL4899825 | 0.69 | IDO1 (0.36) | IDO1 | |
| SCHEMBL30318569 | 0.69 | APLNR (0.44) | — | |
| SCHEMBL647114 | 0.66 | — | — | |
| SCHEMBL21193468 | 0.64 | HSP90AA1 (0.35) | FEN1ALOX5AP |
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-118434744-A | Nitrogen-containing macrocyclic compound, and preparation method and medical application thereof | 中国医药研究开发中心有限公司 | 2024-08-02 | — | — | CN | disclosed |