Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RET | P07949 | 3/20 | 0.47 |
| ▸ | GSK3B | P49841 | 10/20 | 0.44 |
| ▸ | DYRK1A | Q13627 | 10/20 | 0.44 |
| ▸ | WNT1 | P04628 | 6/20 | 0.44 |
| ▸ | CLK2 | P49760 | 1/20 | 0.44 |
| ▸ | CLK3 | P49761 | 1/20 | 0.44 |
| ▸ | SCD5 | Q86SK9 | 2/20 | 0.43 |
| ▸ | SCD | O00767 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.40 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.40 |
| ▸ | NTRK2 | Q16620 | 2/20 | 0.40 |
| ▸ | NTRK3 | Q16288 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL31181992 | 0.88 | WNT1 (0.46) | RETGSK3BDYRK1AWNT1 | |
| SCHEMBL31182013 | 0.84 | WNT1 (0.51) | RETGSK3BDYRK1AWNT1 | |
| SCHEMBL31182012 | 0.83 | CCNC (0.47) | RETGSK3BDYRK1AWNT1 | |
| SCHEMBL31181994 | 0.74 | DYRK1A (0.48) | RETGSK3BDYRK1AWNT1CLK2 | |
| SCHEMBL31181983 | 0.69 | HPGD (0.42) | — | |
| SCHEMBL31182018 | 0.67 | GSK3B (0.38) | RETGSK3BDYRK1AWNT1KCNH2 | |
| SCHEMBL16853691 | 0.64 | NTRK1 (0.66) | GSK3BDYRK1AWNT1CLK2CLK3 | |
| SCHEMBL14597201 | 0.64 | ACHE (0.61) | SCD5 | |
| SCHEMBL27233613 | 0.64 | EPHX2 (0.58) | GSK3BDYRK1AWNT1 | |
| SCHEMBL2091338 | 0.63 | EPHX2 (0.57) | SCD5 |
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 |
|---|---|---|---|---|---|---|---|
| CN-118878508-A | DC-Rhoin derivative, preparation method and application thereof | 广东省中医院（广州中医药大学第二附属医院、广州中医药大学第二临床医学院、广东省中医药科学院） | 2024-11-01 | — | — | CN | disclosed |