Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 14/20 | 0.95 |
| ▸ | HTR1A | P08908 | 13/20 | 0.90 |
| ▸ | HTR2A | P28223 | 13/20 | 0.90 |
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 | |
|---|---|---|---|---|
| SCHEMBL21485214 | 0.97 | DRD2 (1.00) | DRD2HTR1AHTR2A | |
| SCHEMBL21485207 | 0.96 | DRD2 (0.98) | DRD2HTR1AHTR2A | |
| SCHEMBL21485236 | 0.94 | DRD2 (1.00) | DRD2HTR1AHTR2A | |
| SCHEMBL21485238 | 0.91 | DRD2 (1.00) | DRD2HTR1AHTR2A | |
| SCHEMBL21485198 | 0.88 | DRD2 (0.88) | DRD2HTR1AHTR2A | |
| SCHEMBL21485260 | 0.87 | DRD2 (0.94) | DRD2HTR1AHTR2A | |
| SCHEMBL21485162 | 0.87 | DRD2 (0.89) | DRD2HTR1AHTR2A | |
| SCHEMBL1036170 | 0.86 | DRD2 (0.74) | DRD2HTR1AHTR2A | |
| SCHEMBL1037849 | 0.85 | DRD2 (0.75) | DRD2HTR1AHTR2A | |
| SCHEMBL29433204 | 0.85 | DRD2 (0.75) | DRD2HTR1AHTR2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3115361-B1 | HETEROCYCLIC COMPOUNDS, AND PREPARATION METHOD AND USE THEREOF | SHANGHAI INST MATERIA MEDICA CAS (CN) | 2019-10-23 | — | — | EP | claimed |