Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK1 | P23458 | 16/20 | 0.46 |
| ▸ | JAK2 | O60674 | 5/20 | 0.46 |
| ▸ | TYK2 | P29597 | 6/20 | 0.43 |
| ▸ | JAK3 | P52333 | 6/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.43 |
| ▸ | HTR6 | P50406 | 4/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 2/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL25699287 | 0.95 | JAK1 (0.42) | JAK1JAK2TYK2JAK3CYP3A4 | |
| SCHEMBL2223896 | 0.95 | JAK1 (0.42) | JAK1JAK2TYK2JAK3CYP3A4 | |
| SCHEMBL29460490 | 0.95 | JAK1 (0.42) | JAK1JAK2TYK2JAK3CYP3A4 | |
| SCHEMBL25241529 | 0.95 | JAK1 (0.42) | JAK1JAK2TYK2JAK3CYP3A4 | |
| SCHEMBL30995752 | 0.95 | JAK1 (0.42) | JAK1JAK2TYK2JAK3CYP3A4 | |
| SCHEMBL25283735 | 0.95 | JAK1 (0.42) | JAK1JAK2TYK2JAK3CYP3A4 | |
| SCHEMBL2223793 | 0.91 | JAK1 (0.54) | JAK1JAK2TYK2JAK3CYP3A4 | |
| SCHEMBL2282946 | 0.91 | JAK1 (0.54) | JAK1JAK2TYK2JAK3CYP3A4 | |
| SCHEMBL2280654 | 0.90 | JAK1 (0.45) | JAK1JAK2TYK2JAK3CYP3A4 | |
| SCHEMBL2272132 | 0.90 | JAK1 (0.46) | JAK1JAK2TYK2JAK3CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2523957-A1 | TRICYCLIC HETEROCYCLIC COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF | F. Hoffmann-La Roche AG (CH) | 2012-11-21 | — | — | EP | disclosed |
| WO-2011086053-A1 | TRICYCLIC HETEROCYCLIC COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF | F. HOFFMANN-LA ROCHE AG (CH) | 2011-07-21 | — | — | WO | disclosed |