Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 5/20 | 0.79 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.75 |
| ▸ | DRD2 | P14416 | 3/20 | 0.75 |
| ▸ | HTR1A | P08908 | 2/20 | 0.75 |
| ▸ | HTR2A | P28223 | 2/20 | 0.75 |
| ▸ | HTR2C | P28335 | 2/20 | 0.75 |
| ▸ | HRH1 | P35367 | 2/20 | 0.75 |
| ▸ | DRD3 | P35462 | 2/20 | 0.75 |
| ▸ | DRD1 | P21728 | 1/20 | 0.75 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.74 |
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 | |
|---|---|---|---|---|
| SCHEMBL30728645 | 1.00 | HTR6 (0.79) | HTR6KCNH2DRD2HTR1AHTR2A | |
| SCHEMBL23409241 | 0.98 | HTR6 (0.78) | HTR6KCNH2DRD2HTR1AHTR2A | |
| SCHEMBL30083635 | 0.98 | HTR6 (0.78) | HTR6KCNH2DRD2HTR1AHTR2A | |
| Bromide SCHEMBL30647908 | 0.97 | HTR6 (0.77) | HTR6KCNH2DRD2HTR1AHTR2A | |
| Hydrochloric Acid SCHEMBL30083608 | 0.97 | HTR6 (0.77) | HTR6KCNH2DRD2HTR1AHTR2A | |
| SCHEMBL23409204 | 0.95 | HTR6 (0.72) | HTR6KCNH2DRD2HTR1AHTR2A | |
| SCHEMBL23409210 | 0.95 | HTR6 (0.74) | HTR6KCNH2DRD2HTR1AHTR2A | |
| SCHEMBL30728636 | 0.95 | HTR6 (0.74) | HTR6KCNH2DRD2HTR1AHTR2A | |
| Sulfuric Acid SCHEMBL30083657 | 0.94 | HTR6 (0.74) | HTR6KCNH2DRD2HTR1AHTR2A | |
| Phosphoric Acid SCHEMBL30647929 | 0.94 | HTR6 (0.73) | HTR6KCNH2DRD2HTR1AHTR2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114728956-B | Fused heterocyclic derivative and application thereof | 上海枢境生物科技有限公司 | 2024-01-12 | — | — | CN | disclosed |
| WO-2021098737-A1 | FUSED HETEROCYCLIC DERIVATIVE AND USE THEREOF | 上海枢境生物科技有限公司 | 2021-05-27 | — | — | WO | disclosed |