Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPYD | Q12882 | 1/20 | 0.41 |
| ▸ | MCL1 | Q07820 | 10/20 | 0.40 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.38 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.36 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.36 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | CHUK | O15111 | 2/20 | 0.33 |
| ▸ | CDK2 | P24941 | 1/20 | 0.32 |
| ▸ | GSK3B | P49841 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL27174968 | 0.75 | DYRK1A (0.47) | DPYDMCL1DYRK1ACHUK | |
| SCHEMBL3528687 | 0.74 | PDPK1 (0.39) | ALDH1A1GSK3B | |
| SCHEMBL4474629 | 0.74 | DPYD (0.35) | DPYDALDH1A1GSK3B | |
| SCHEMBL25754505 | 0.74 | GPR35 (0.33) | ALDH1A1GSK3B | |
| SCHEMBL31128869 | 0.70 | KDM4E (0.42) | CHEK1DYRK1AKDM4EGSK3B | |
| SCHEMBL3088202 | 0.69 | GSK3B (0.41) | DPYDMCL1CHEK1PIK3CDPIK3CA | |
| SCHEMBL3069636 | 0.68 | DPYD (0.42) | DPYDMCL1PIK3CDPIK3CAPIK3CB | |
| SCHEMBL25755671 | 0.68 | KDM4E (0.38) | KDM4EALDH1A1 | |
| SCHEMBL3617645 | 0.66 | TNKS (0.47) | DPYDMCL1DYRK1AKDM4EALDH1A1 | |
| SCHEMBL3086572 | 0.66 | DPYD (0.40) | DPYDMCL1CHEK1PIK3CDPIK3CA |
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-2024208315-A1 | AROMATIC HETEROCYCLIC COMPOUND, AND PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF | 中国医药研究开发中心有限公司 | 2024-10-10 | — | — | WO | disclosed |
| WO-2023109954-A1 | TYK2 INHIBITORS AND COMPOSITIONS AND METHODS THEREOF | LYNK PHARMACEUTICALS CO. LTD. (CN) | 2023-06-22 | — | — | WO | disclosed |