Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYK2 | P29597 | 6/20 | 0.51 |
| ▸ | JAK3 | P52333 | 5/20 | 0.51 |
| ▸ | JAK1 | P23458 | 4/20 | 0.51 |
| ▸ | JAK2 | O60674 | 3/20 | 0.50 |
| ▸ | NTRK1 | P04629 | 8/20 | 0.45 |
| ▸ | AURKA | O14965 | 6/20 | 0.43 |
| ▸ | AURKB | Q96GD4 | 4/20 | 0.43 |
| ▸ | SRC | P12931 | 2/20 | 0.43 |
| ▸ | GSK3B | P49841 | 2/20 | 0.43 |
| ▸ | EIF2AK2 | P19525 | 1/20 | 0.42 |
| ▸ | GSK3A | P49840 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL22054049 | 0.92 | TYK2 (0.56) | TYK2JAK3JAK1JAK2NTRK1 | |
| SCHEMBL22054588 | 0.92 | TYK2 (0.51) | TYK2JAK3JAK1JAK2NTRK1 | |
| SCHEMBL22055054 | 0.91 | TYK2 (0.52) | TYK2JAK3JAK1JAK2NTRK1 | |
| SCHEMBL22055235 | 0.91 | TYK2 (0.49) | TYK2JAK3JAK1JAK2NTRK1 | |
| SCHEMBL23878984 | 0.90 | TYK2 (0.62) | TYK2JAK3JAK1JAK2NTRK1 | |
| SCHEMBL22054314 | 0.90 | TYK2 (0.62) | TYK2JAK3JAK1JAK2NTRK1 | |
| SCHEMBL22055052 | 0.88 | TYK2 (0.52) | TYK2JAK3JAK1JAK2NTRK1 | |
| SCHEMBL22055174 | 0.88 | TYK2 (0.53) | TYK2JAK3JAK1JAK2NTRK1 | |
| SCHEMBL22054583 | 0.88 | TYK2 (0.46) | TYK2JAK3JAK1JAK2NTRK1 | |
| SCHEMBL24071557 | 0.87 | TYK2 (0.49) | TYK2JAK3JAK1JAK2NTRK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020108613-A1 | HETEROAROMATIC DERIVATIVES FOR USE AS REGULATOR, PREPARATION METHOD THEREFOR AND USE THEREOF | 江苏豪森药业集团有限公司 | 2020-06-04 | — | — | WO | disclosed |