Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK1 | P23458 | 10/20 | 0.36 |
| ▸ | JAK2 | O60674 | 6/20 | 0.32 |
| ▸ | TYK2 | P29597 | 5/20 | 0.32 |
| ▸ | JAK3 | P52333 | 5/20 | 0.32 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.31 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.30 |
| ▸ | BTK | Q06187 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL12472992 | 0.85 | MAPK8 (0.33) | — | |
| SCHEMBL11900807 | 0.81 | PIK3CD (0.42) | JAK1 | |
| SCHEMBL12472409 | 0.80 | CYP11B2 (0.38) | JAK1JAK2TYK2JAK3CYP11B2 | |
| SCHEMBL12472673 | 0.79 | NPC1 (0.46) | — | |
| SCHEMBL12472675 | 0.79 | NPC1 (0.46) | — | |
| SCHEMBL12472836 | 0.76 | MAPK1 (0.33) | BTK | |
| SCHEMBL12472028 | 0.74 | PIK3CG (0.33) | — | |
| SCHEMBL12472245 | 0.73 | CDK1 (0.37) | — | |
| SCHEMBL12472542 | 0.71 | CDK1 (0.37) | — | |
| SCHEMBL12472023 | 0.71 | HTT (0.35) | — |
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-2673269-A1 | HETEROCYCLIC COMPOUNDS AS PI3 KINASE INHIBITORS | F.HOFFMANN-LA ROCHE AG (CH) | 2013-12-18 | — | — | EP | disclosed |
| WO-2012107465-A1 | HETEROCYCLIC COMPOUNDS AS PI3 KINASE INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2012-08-16 | — | — | WO | disclosed |