Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 3/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.36 |
| ▸ | CSNK2A2 | P19784 | 3/20 | 0.36 |
| ▸ | CSNK2B | P67870 | 3/20 | 0.36 |
| ▸ | CSNK2A1 | P68400 | 3/20 | 0.36 |
| ▸ | CDK1 | P06493 | 2/20 | 0.35 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.35 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.35 |
| ▸ | CDK4 | P11802 | 1/20 | 0.35 |
| ▸ | CCND1 | P24385 | 1/20 | 0.35 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.35 |
| ▸ | CDK2 | P24941 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | GPR35 | Q9HC97 | 6/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL23887406 | 0.85 | CCNE2 (0.36) | CSNK2A2CSNK2BCSNK2A1CDK1CCNB1 | |
| SCHEMBL23887031 | 0.84 | GPR35 (0.37) | MAOBCDK1CCNB1CCNE2CDK4 | |
| SCHEMBL30564425 | 0.82 | CCNE2 (0.34) | CDK1CCNB1CCNE2CDK4CCND1 | |
| SCHEMBL24713822 | 0.81 | KDM4E (0.35) | CDK1CCNB1CCNE2CDK4CCND1 | |
| SCHEMBL23886930 | 0.81 | CCNE2 (0.34) | CDK1CCNB1CCNE2CDK4CCND1 | |
| SCHEMBL23887035 | 0.80 | PRKDC (0.42) | MAOBMAOACDK1CCNB1CCNE2 | |
| SCHEMBL23886987 | 0.80 | SIRT2 (0.56) | MAOBMAOASIRT2CSNK2A2CSNK2B | |
| SCHEMBL30564388 | 0.79 | GAA (0.34) | CDK1CCNB1CCNE2CDK4CCND1 | |
| SCHEMBL30434136 | 0.75 | SIRT2 (0.38) | MAOBSIRT2CSNK2A2CSNK2BCSNK2A1 | |
| SCHEMBL30564491 | 0.73 | CCNE2 (0.35) | CDK1CCNB1CCNE2CDK4CCND1 |
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 |