Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD3 | P35462 | 5/20 | 0.62 |
| ▸ | HTR1A | P08908 | 4/20 | 0.62 |
| ▸ | HTR2A | P28223 | 4/20 | 0.62 |
| ▸ | HTR7 | P34969 | 4/20 | 0.62 |
| ▸ | HTR2C | P28335 | 3/20 | 0.62 |
| ▸ | DRD4 | P21917 | 2/20 | 0.62 |
| ▸ | MAOB | P27338 | 5/20 | 0.61 |
| ▸ | MAOA | P21397 | 4/20 | 0.61 |
| ▸ | DRD2 | P14416 | 3/20 | 0.60 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.60 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.58 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.58 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.57 |
| ▸ | DRD1 | P21728 | 2/20 | 0.54 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.53 |
| ▸ | DRD5 | P21918 | 1/20 | 0.53 |
| ▸ | HRH1 | P35367 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL23409211 | 0.88 | DRD2 (0.53) | DRD3HTR1AHTR2AHTR7HTR2C | |
| SCHEMBL23409228 | 0.82 | MAOA (0.58) | DRD3DRD4MAOBMAOADRD2 | |
| SCHEMBL30728638 | 0.82 | MAOA (0.58) | DRD3DRD4MAOBMAOADRD2 | |
| SCHEMBL23409975 | 0.80 | DRD2 (0.53) | DRD3HTR1AHTR2ADRD4DRD2 | |
| SCHEMBL30728641 | 0.80 | DRD2 (0.67) | HTR1AHTR2AHTR7HTR2CDRD2 | |
| SCHEMBL23409238 | 0.80 | DRD2 (0.67) | HTR1AHTR2AHTR7HTR2CDRD2 | |
| SCHEMBL11267442 | 0.79 | MAOB (0.67) | DRD3HTR1AHTR2AHTR7HTR2C | |
| SCHEMBL30728639 | 0.79 | DRD2 (0.62) | DRD3HTR1AHTR2AHTR7HTR2C | |
| SCHEMBL23409236 | 0.79 | DRD2 (0.62) | DRD3HTR1AHTR2AHTR7HTR2C | |
| SCHEMBL23409561 | 0.78 | HRH3 (0.46) | MAOBMAOAHRH3HRH1 |
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-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 |