Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GBA1 | P04062 | 2/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.33 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.31 |
| ▸ | MAP3K12 | Q12852 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29341763 | 1.00 | GBA1 (0.39) | GBA1DRD3SIGMAR1LRRK2MAP3K12 | |
| SCHEMBL9870712 | 0.86 | DRD3 (0.35) | DRD3SIGMAR1 | |
| SCHEMBL23205043 | 0.82 | KCNJ1 (0.39) | GBA1DRD3SIGMAR1LRRK2MAP3K12 | |
| SCHEMBL25608578 | 0.82 | KCNJ1 (0.39) | GBA1DRD3SIGMAR1LRRK2MAP3K12 | |
| SCHEMBL21208116 | 0.82 | — | — | |
| SCHEMBL20284442 | 0.81 | GBA1 (0.37) | GBA1DRD3SIGMAR1LRRK2MAP3K12 | |
| SCHEMBL20694667 | 0.79 | GBA1 (0.36) | GBA1OPRM1 | |
| SCHEMBL22098703 | 0.78 | GBA1 (0.35) | GBA1DRD3SIGMAR1 | |
| SCHEMBL13849313 | 0.78 | GBA1 (0.35) | GBA1DRD3SIGMAR1 | |
| SCHEMBL29646200 | 0.77 | GAA (0.33) | GBA1KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4400497-A1 | 3CLPRO PROTEASE INHIBITOR | Shanghai Qilu Pharmaceutical Research and Development Centre Ltd. (CN) | 2024-07-17 | — | — | EP | disclosed |
| WO-2020168172-A1 | CONJUGATE COMPOUNDS FOR THE DEGRADATION OF RAF | ZAMBONI CHEM SOLUTIONS INC. (CA) | 2020-08-20 | — | — | WO | disclosed |