Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYK2 | P29597 | 12/20 | 0.47 |
| ▸ | JAK3 | P52333 | 11/20 | 0.47 |
| ▸ | JAK1 | P23458 | 8/20 | 0.47 |
| ▸ | AURKA | O14965 | 4/20 | 0.46 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.46 |
| ▸ | JAK2 | O60674 | 7/20 | 0.44 |
| ▸ | PLK4 | O00444 | 1/20 | 0.40 |
| ▸ | NTRK1 | P04629 | 3/20 | 0.39 |
| ▸ | GSK3B | P49841 | 2/20 | 0.39 |
| ▸ | SRC | P12931 | 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 | |
|---|---|---|---|---|
| SCHEMBL23889221 | 1.00 | TYK2 (0.47) | TYK2JAK3JAK1AURKAAURKB | |
| SCHEMBL23889436 | 0.90 | TYK2 (0.42) | TYK2JAK3JAK1AURKAAURKB | |
| SCHEMBL22054460 | 0.86 | TYK2 (0.63) | TYK2JAK3JAK1AURKAAURKB | |
| SCHEMBL23878940 | 0.86 | TYK2 (0.63) | TYK2JAK3JAK1AURKAAURKB | |
| SCHEMBL22054057 | 0.85 | TYK2 (0.44) | TYK2JAK3JAK1AURKAJAK2 | |
| SCHEMBL23889402 | 0.84 | TYK2 (0.46) | TYK2JAK3JAK1JAK2PLK4 | |
| SCHEMBL23889716 | 0.83 | TYK2 (0.55) | TYK2JAK3JAK1AURKAJAK2 | |
| SCHEMBL22054571 | 0.82 | AURKA (0.56) | TYK2JAK3JAK1AURKAAURKB | |
| SCHEMBL23889550 | 0.81 | TYK2 (0.43) | TYK2JAK3JAK1AURKAAURKB | |
| SCHEMBL23889284 | 0.81 | TYK2 (0.43) | TYK2JAK3JAK1AURKAAURKB |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2021238908-A1 | SALT AND CRYSTAL FORM OF HETEROARYL DERIVATIVE, AND PREPARATION METHOD THEREFOR | 上海翰森生物医药科技有限公司 | 2021-12-02 | — | — | WO | disclosed |
| EP-3889152-A1 | HETEROAROMATIC DERIVATIVES FOR USE AS REGULATOR, PREPARATION METHOD THEREFOR AND USE THEREOF | Jiangsu Hansoh Pharmaceutical Group Co., Ltd. (CN) | 2021-10-06 | — | — | EP | disclosed |
| 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 |