Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 1/20 | 0.59 |
| ▸ | RAB9A | P51151 | 1/20 | 0.55 |
| ▸ | MASP2 | O00187 | 1/20 | 0.55 |
| ▸ | NPY5R | Q15761 | 4/20 | 0.52 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.52 |
| ▸ | NQO2 | P16083 | 1/20 | 0.50 |
| ▸ | GSK3B | P49841 | 1/20 | 0.49 |
| ▸ | BRD4 | O60885 | 1/20 | 0.46 |
| ▸ | HPGDS | O60760 | 2/20 | 0.45 |
| ▸ | CDC7 | O00311 | 1/20 | 0.44 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.44 |
| ▸ | CDK2 | P24941 | 1/20 | 0.44 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.44 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.42 |
| ▸ | KLK1 | P06870 | 1/20 | 0.42 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.42 |
| ▸ | BRS3 | P32247 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL27992257 | 0.85 | SCN2A (0.55) | SCN9ARAB9AMASP2NPY5RSCN2A | |
| SCHEMBL2330004 | 0.85 | NPY5R (0.55) | SCN9ARAB9AMASP2NPY5RSCN2A | |
| SCHEMBL11229277 | 0.82 | SCN2A (0.52) | SCN9ARAB9AMASP2NPY5RSCN2A | |
| SCHEMBL15135617 | 0.81 | NPY5R (0.50) | SCN9ARAB9AMASP2NPY5RSCN2A | |
| SCHEMBL2026067 | 0.77 | MAPT (0.56) | SCN9ARAB9AMASP2NPY5RSCN2A | |
| SCHEMBL28163525 | 0.76 | GSK3B (0.44) | SCN9ARAB9AGSK3BHPGDSCDC7 | |
| SCHEMBL5448133 | 0.76 | SCN9A (1.00) | SCN9ANPY5RSCN2AGSK3B | |
| SCHEMBL985896 | 0.71 | GSK3B (0.46) | SCN9AGSK3BCDC7CCNA2CDK2 | |
| SCHEMBL725351 | 0.71 | MASP2 (1.00) | SCN9ARAB9AMASP2NPY5RSCN2A | |
| SCHEMBL22307353 | 0.70 | SCN9A (0.48) | SCN9ANPY5RSCN2AHPGDSMAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-117794896-A | Protease inhibitors for the treatment of coronavirus infections | 斯克里普斯研究学院 | 2024-03-29 | — | — | CN | claimed |
| CN-117794896-A | Protease inhibitors for the treatment of coronavirus infections | 斯克里普斯研究学院 | 2024-03-29 | — | — | CN | disclosed |