Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR5A | P47898 | 1/20 | 0.35 |
| ▸ | CD44 | P16070 | 3/20 | 0.34 |
| ▸ | HTR2C | P28335 | 6/20 | 0.33 |
| ▸ | HTR2B | P41595 | 4/20 | 0.33 |
| ▸ | HTR2A | P28223 | 3/20 | 0.33 |
| ▸ | PNMT | P11086 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL19010372 | 0.75 | TRPA1 (0.39) | HTR5ACD44HTR2CHTR2A | |
| SCHEMBL25027774 | 0.72 | CD44 (0.38) | HTR5ACD44HTR2CHTR2B | |
| SCHEMBL24712806 | 0.72 | CD44 (0.41) | CD44HTR2CHTR2BHTR2APNMT | |
| SCHEMBL22989888 | 0.67 | HTR5A (0.37) | HTR5ACD44 | |
| SCHEMBL24712997 | 0.67 | PRCP (0.36) | CD274 | |
| SCHEMBL5068782 | 0.66 | CD44 (0.42) | HTR5ACD44HTR2CPNMTMAOB | |
| SCHEMBL29750070 | 0.66 | CD44 (0.42) | HTR5ACD44HTR2CPNMTMAOB | |
| SCHEMBL14712000 | 0.65 | KDM1A (0.42) | HTR5ACD44 | |
| SCHEMBL28217583 | 0.65 | CD44 (0.39) | HTR5ACD44MAOB | |
| SCHEMBL28218037 | 0.65 | HTR5A (0.35) | HTR5ACD44HTR2CHTR2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022218391-A1 | CHIRAL SPIRO AMMONIUM SALT COMPOUND, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF | 西湖大学 | 2022-10-20 | — | — | WO | disclosed |