Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | PDE5A | O76074 | 3/20 | 0.35 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 2/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | MGAM | O43451 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | SI | P14410 | 1/20 | 0.33 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28934326 | 1.00 | ACHE (0.36) | ACHEPDE5ACRHR1THRBL3MBTL1 | |
| SCHEMBL30108691 | 0.95 | THRB (0.34) | ACHEPDE5ACRHR1THRBL3MBTL1 | |
| SCHEMBL28934436 | 0.91 | ACHE (0.41) | ACHEPDE5ACRHR1THRBL3MBTL1 | |
| SCHEMBL28934496 | 0.87 | PDE5A (0.46) | ACHEPDE5ACRHR1L3MBTL1ALDH1A1 | |
| SCHEMBL28934716 | 0.86 | ACHE (0.37) | ACHECRHR1L3MBTL1LMNASMN1; SMN2 | |
| SCHEMBL28934710 | 0.85 | ACHE (0.41) | ACHEPDE5ACRHR1THRBL3MBTL1 | |
| SCHEMBL28934449 | 0.85 | KDM4E (0.40) | ACHEPDE5ACRHR1L3MBTL1LMNA | |
| SCHEMBL28934464 | 0.84 | MAPT (0.40) | ACHECRHR1L3MBTL1LMNASMN1; SMN2 | |
| SCHEMBL25257750 | 0.84 | AMY1A (0.39) | THRBLMNAALDH1A1MEN1KMT2A | |
| SCHEMBL30108829 | 0.83 | THRB (0.38) | CRHR1THRBSMN1; SMN2ALDH1A1MEN1 |
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-115433163-A | NLRP3 inflammasome inhibitor and application thereof | 药捷安康(南京)科技股份有限公司 | 2022-12-06 | — | — | CN | disclosed |