Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | HTR2C | P28335 | 1/20 | 0.44 |
| ▸ | HTR2B | P41595 | 1/20 | 0.44 |
| ▸ | CD44 | P16070 | 2/20 | 0.40 |
| ▸ | PNMT | P11086 | 6/20 | 0.38 |
| ▸ | ASIC3 | Q9UHC3 | 2/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.34 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.34 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.34 |
| ▸ | IRAK4 | Q9NWZ3 | 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 | |
|---|---|---|---|---|
| SCHEMBL25592782 | 0.90 | HTR2A (0.47) | HTR2AHTR2CHTR2BCD44PNMT | |
| SCHEMBL25602176 | 0.88 | HTR2A (0.33) | HTR2AHTR2CHTR2B | |
| SCHEMBL25599498 | 0.69 | CYP11B1 (0.34) | — | |
| SCHEMBL25602178 | 0.69 | — | — | |
| SCHEMBL952615 | 0.66 | — | — | |
| SCHEMBL123650 | 0.66 | CD44 (0.49) | CD44PNMTMAOB | |
| SCHEMBL25593257 | 0.66 | — | — | |
| Hydrochloric Acid SCHEMBL20424855 | 0.65 | CHRM3 (0.39) | HTR2AHTR2CHTR2BCD44PNMT | |
| SCHEMBL29876517 | 0.64 | CD44 (0.39) | HTR2AHTR2CHTR2BCD44PNMT | |
| SCHEMBL25816630 | 0.64 | HTR2C (0.40) | HTR2AHTR2CHTR2BCD44PNMT |
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-2023125944-A1 | COMPOUND CONTAINING HETEROCYCLIC RING | 正大天晴药业集团股份有限公司 | 2023-07-06 | — | — | WO | disclosed |