Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 17/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 17/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 15/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 9/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.34 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.34 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.34 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3532559 | 0.69 | ADRA2A (0.34) | SLC6A2SLC6A4CYP2D6ADRA2AADRA2B | |
| SCHEMBL6252127 | 0.69 | ADRA2A (0.41) | CYP2D6ADRA2AADRA2BADRA2CADRA1B | |
| SCHEMBL28478349 | 0.67 | OPRM1 (0.36) | ADRA2AADRA2BADRA2CADRA1B | |
| Hydrochloric Acid SCHEMBL28508991 | 0.66 | OPRM1 (0.35) | — | |
| SCHEMBL6250927 | 0.65 | ADRA1A (0.54) | CYP2D6ADRA2AADRA1B | |
| SCHEMBL8865254 | 0.64 | OPRM1 (0.36) | — | |
| Atipamezole SCHEMBL881064 | 0.63 | ADRA2A (0.51) | CYP2D6ADRA2AADRA2BADRA2CADRA1B | |
| SCHEMBL6253507 | 0.63 | ADRA2A (0.36) | ADRA2AADRA2BADRA2CADRA1B | |
| SCHEMBL5827252 | 0.63 | ADRA1A (0.44) | CYP2D6 | |
| Atipamezole SCHEMBL31147780 | 0.62 | ADRA2A (0.50) | CYP2D6ADRA2AADRA2BADRA2CADRA1B |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112225700-B | Preparation method of atemezole | 湖南新合新生物医药有限公司 | 2023-11-17 | — | — | CN | disclosed |
| CN-112225700-A | Preparation method of altimezole | 湖南新合新生物医药有限公司 | 2021-01-15 | — | — | CN | disclosed |
| CN-111925330-A | Preparation method of altimezole | 上海阿达玛斯试剂有限公司 | 2020-11-13 | — | — | CN | disclosed |