Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNE2 | O96020 | 1/20 | 0.35 |
| ▸ | CDK1 | P06493 | 1/20 | 0.35 |
| ▸ | CDK4 | P11802 | 1/20 | 0.35 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.35 |
| ▸ | CCND1 | P24385 | 1/20 | 0.35 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.35 |
| ▸ | CDK2 | P24941 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 3/20 | 0.34 |
| ▸ | ELANE | P08246 | 4/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 3/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL30564398 | 0.80 | ELANE (0.35) | CCNE2CDK1CDK4CCNB1CCND1 | |
| SCHEMBL30564383 | 0.79 | GAA (0.34) | GAAELANESMN1; SMN2L3MBTL1HTT | |
| SCHEMBL30564440 | 0.79 | CCNE2 (0.34) | CCNE2CDK1CDK4CCNB1CCND1 | |
| SCHEMBL23887406 | 0.76 | CCNE2 (0.36) | CCNE2CDK1CDK4CCNB1CCND1 | |
| SCHEMBL30564356 | 0.76 | CCNE2 (0.32) | CCNE2CDK1CDK4CCNB1CCND1 | |
| SCHEMBL30564359 | 0.73 | GAA (0.31) | GAA | |
| SCHEMBL30564466 | 0.73 | MAOB (0.38) | CCNE2CDK1CDK4CCNB1CCND1 | |
| SCHEMBL23887031 | 0.73 | GPR35 (0.37) | CCNE2CDK1CDK4CCNB1CCND1 | |
| SCHEMBL23887035 | 0.71 | PRKDC (0.42) | CCNE2CDK1CDK4CCNB1CCND1 | |
| SCHEMBL30564425 | 0.71 | CCNE2 (0.34) | CCNE2CDK1CDK4CCNB1CCND1 |
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-116715658-A | Benzocyclic ketone derivative regulator, preparation method and application thereof | 上海翰森生物医药科技有限公司 | 2023-09-08 | — | — | CN | disclosed |