Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.36 |
| ▸ | DRD3 | P35462 | 4/20 | 0.34 |
| ▸ | DRD2 | P14416 | 3/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL24521452 | 0.79 | DRD3 (0.44) | SIGMAR1HRH3DRD3MAPT | |
| SCHEMBL3563316 | 0.75 | SIGMAR1 (0.43) | SIGMAR1HRH3DRD3DRD2 | |
| SCHEMBL13701722 | 0.73 | SIGMAR1 (0.55) | SIGMAR1HRH3DRD2 | |
| SCHEMBL13962700 | 0.71 | SIGMAR1 (0.54) | SIGMAR1HRH3DRD2 | |
| SCHEMBL21888379 | 0.71 | MGLL (0.44) | — | |
| SCHEMBL6949945 | 0.69 | SIGMAR1 (0.42) | SIGMAR1HRH3DRD3DRD2 | |
| SCHEMBL16975615 | 0.69 | PIK3CD (0.38) | SIGMAR1HRH3DRD3MAPT | |
| SCHEMBL6945637 | 0.69 | SIGMAR1 (0.40) | SIGMAR1HRH3DRD3DRD2MAPT | |
| SCHEMBL23842288 | 0.69 | MAPK1 (0.33) | HRH3 | |
| SCHEMBL10070724 | 0.68 | ALDH1A1 (0.38) | SIGMAR1HRH3DRD3 |
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-3380474-B1 | JANUS KINASES INHIBITORS, COMPOSITIONS THEREOF AND USE THEREOF | HOFFMANN LA ROCHE (CH) | 2019-08-21 | — | — | EP | disclosed |