Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 2/20 | 0.35 |
| ▸ | DRD3 | P35462 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 2/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 11/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 10/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 6/20 | 0.32 |
| ▸ | HTR2A | P28223 | 3/20 | 0.32 |
| ▸ | HTR2B | P41595 | 2/20 | 0.32 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.32 |
| ▸ | HRH1 | P35367 | 1/20 | 0.31 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.31 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.31 |
| ▸ | HTR3A | P46098 | 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 | |
|---|---|---|---|---|
| SCHEMBL30101002 | 0.85 | DRD2 (0.36) | DRD2DRD3HTR1ASLC6A2SLC6A4 | |
| SCHEMBL30100996 | 0.82 | DRD2 (0.45) | DRD2DRD3HTR1AHTR2A | |
| SCHEMBL30100968 | 0.73 | SLC6A2 (0.33) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL30100971 | 0.73 | SLC6A2 (0.33) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL31116712 | 0.67 | SLC6A2 (0.37) | DRD2DRD3HTR1ASLC6A2SLC6A4 | |
| SCHEMBL31116801 | 0.67 | SLC6A2 (0.37) | DRD2DRD3HTR1ASLC6A2SLC6A4 | |
| SCHEMBL31116723 | 0.67 | SLC6A2 (0.37) | DRD2DRD3HTR1ASLC6A2SLC6A4 | |
| SCHEMBL31116797 | 0.65 | DRD2 (0.35) | DRD2DRD3HTR1ASLC6A2SLC6A4 | |
| SCHEMBL7010502 | 0.65 | DRD2 (0.47) | DRD2DRD3HTR1AHTR2A | |
| Acetone SCHEMBL22660844 | 0.62 | DRD2 (0.44) | DRD2DRD3SLC6A3KCNH2 |
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-115433205-A | Polycyclic derivative receptor agonist, preparation method and application thereof | 上海翰森生物医药科技有限公司 | 2022-12-06 | — | — | CN | disclosed |