Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 6/20 | 0.44 |
| ▸ | HTR2C | P28335 | 6/20 | 0.44 |
| ▸ | HTR2B | P41595 | 6/20 | 0.44 |
| ▸ | PDE4B | Q07343 | 7/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | PDE4A | P27815 | 3/20 | 0.36 |
| ▸ | PDE4C | Q08493 | 3/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.36 |
| ▸ | STS | P08842 | 1/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
| ▸ | SUV39H2 | Q9H5I1 | 1/20 | 0.34 |
| ▸ | FFAR2 | O15552 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29164179 | 1.00 | HTR2A (0.44) | HTR2AHTR2CHTR2BPDE4BDRD2 | |
| SCHEMBL30721093 | 1.00 | HTR2A (0.44) | HTR2AHTR2CHTR2BPDE4BDRD2 | |
| SCHEMBL29164180 | 0.89 | HTR2A (0.45) | HTR2AHTR2CHTR2BPDE4BDRD2 | |
| SCHEMBL30721087 | 0.89 | HTR2A (0.45) | HTR2AHTR2CHTR2BPDE4BDRD2 | |
| SCHEMBL29164183 | 0.89 | HTR2A (0.45) | HTR2AHTR2CHTR2BPDE4BDRD2 | |
| SCHEMBL30721060 | 0.88 | HTR2A (0.41) | HTR2AHTR2CHTR2BPDE4BDRD2 | |
| SCHEMBL29164185 | 0.88 | HTR2A (0.41) | HTR2AHTR2CHTR2BPDE4BDRD2 | |
| SCHEMBL29164189 | 0.88 | HTR2A (0.41) | HTR2AHTR2CHTR2BPDE4BDRD2 | |
| SCHEMBL30120779 | 0.86 | HTR2A (0.45) | HTR2AHTR2CHTR2BDRD2FFAR2 | |
| SCHEMBL30721081 | 0.83 | ALDH1A1 (0.43) | HTR2AHTR2CHTR2BPDE4BPDE4A |
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-117337280-A | Aryl heterocyclic compounds as Kv1.3 potassium SHAKER channel blockers | D·E·萧尔研究有限责任公司 | 2024-01-02 | — | — | CN | disclosed |