Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK1 | P23458 | 17/20 | 0.42 |
| ▸ | JAK2 | O60674 | 5/20 | 0.42 |
| ▸ | HTR6 | P50406 | 3/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | TYK2 | P29597 | 7/20 | 0.40 |
| ▸ | JAK3 | P52333 | 7/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL25241529 | 1.00 | JAK1 (0.42) | JAK1JAK2HTR6MAOBTYK2 | |
| SCHEMBL25699287 | 1.00 | JAK1 (0.42) | JAK1JAK2HTR6MAOBTYK2 | |
| SCHEMBL30995752 | 1.00 | JAK1 (0.42) | JAK1JAK2HTR6MAOBTYK2 | |
| SCHEMBL2223896 | 1.00 | JAK1 (0.42) | JAK1JAK2HTR6MAOBTYK2 | |
| SCHEMBL25283735 | 1.00 | JAK1 (0.42) | JAK1JAK2HTR6MAOBTYK2 | |
| SCHEMBL2280654 | 0.95 | JAK1 (0.45) | JAK1JAK2HTR6MAOBTYK2 | |
| SCHEMBL2224738 | 0.95 | JAK1 (0.46) | JAK1JAK2HTR6TYK2JAK3 | |
| SCHEMBL2273561 | 0.89 | JAK1 (0.43) | JAK1JAK2HTR6MAOBTYK2 | |
| SCHEMBL2273559 | 0.89 | JAK1 (0.43) | JAK1JAK2HTR6MAOBTYK2 | |
| SCHEMBL2282946 | 0.88 | JAK1 (0.54) | 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 |
|---|---|---|---|---|---|---|---|
| WO-2023115327-A1 | PYRIDO RING COMPOUND, PREPARATION METHOD THEREFOR, INTERMEDIATE, COMPOSITION, AND APPLICATION | 中国药科大学 | 2023-06-29 | — | — | WO | disclosed |
| CN-114149428-A | Pyridine-fused ring compound and preparation method, intermediate, composition and application thereof | 中国药科大学 | 2022-03-08 | — | — | CN | disclosed |