Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RET | P07949 | 4/20 | 0.49 |
| ▸ | TYK2 | P29597 | 15/20 | 0.47 |
| ▸ | JAK3 | P52333 | 15/20 | 0.47 |
| ▸ | JAK1 | P23458 | 12/20 | 0.47 |
| ▸ | JAK2 | O60674 | 9/20 | 0.47 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.43 |
| ▸ | P2RX2 | Q9UBL9 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL22056487 | 0.84 | JAK1 (0.59) | TYK2JAK3JAK1JAK2P2RX3 | |
| SCHEMBL30923622 | 0.83 | RET (0.50) | RETTYK2JAK3JAK1JAK2 | |
| SCHEMBL22056475 | 0.83 | RET (0.50) | RETTYK2JAK3JAK1JAK2 | |
| SCHEMBL22056479 | 0.82 | RET (0.47) | RETTYK2JAK3JAK1JAK2 | |
| SCHEMBL23878890 | 0.81 | TYK2 (0.49) | TYK2JAK3JAK1JAK2P2RX3 | |
| SCHEMBL30227729 | 0.81 | TYK2 (0.49) | TYK2JAK3JAK1JAK2P2RX3 | |
| SCHEMBL22055393 | 0.81 | TYK2 (0.49) | TYK2JAK3JAK1JAK2P2RX3 | |
| SCHEMBL22055839 | 0.80 | RET (0.50) | RETTYK2JAK3JAK1JAK2 | |
| SCHEMBL22055867 | 0.80 | RET (0.50) | RETTYK2JAK3JAK1JAK2 | |
| SCHEMBL23878888 | 0.77 | JAK3 (0.48) | RETTYK2JAK3JAK1JAK2 |
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-2020108516-A1 | NITROGEN-CONTAINING HETEROARYL DERIVATIVE REGULATOR, PREPARATION METHOD THEREFOR, AND USES THEREOF | 江苏豪森药业集团有限公司 | 2020-06-04 | — | — | WO | disclosed |