Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PBRM1 | Q86U86 | 2/20 | 0.39 |
| ▸ | PARP1 | P09874 | 2/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA7 | P43166 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 5/20 | 0.34 |
| ▸ | MAOB | P27338 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | MAP1LC3B | Q9GZQ8 | 1/20 | 0.31 |
| ▸ | TOP2A | P11388 | 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 | |
|---|---|---|---|---|
| SCHEMBL12718595 | 0.78 | HTR2A (0.38) | PBRM1CA1CA2CA7CA9 | |
| SCHEMBL30431228 | 0.78 | PBRM1 (0.36) | PBRM1PARP1CA1CA2CA7 | |
| SCHEMBL4496694 | 0.77 | MAOA (0.34) | PARP1MAOAMAOBALDH1A1LMNA | |
| SCHEMBL1869956 | 0.77 | ADORA2A (0.37) | PARP1MAOAMAOBALDH1A1CYP3A4 | |
| SCHEMBL4488117 | 0.77 | MAOA (0.53) | MAOAMAOBALDH1A1LMNAMAPK1 | |
| SCHEMBL17671008 | 0.77 | MAOA (0.34) | PARP1MAOAMAOBALDH1A1LMNA | |
| SCHEMBL29838119 | 0.77 | MAOA (0.34) | PARP1MAOAMAOBALDH1A1LMNA | |
| SCHEMBL4496746 | 0.77 | PBRM1 (0.39) | PBRM1MAOAMAOBMAPK1HTT | |
| SCHEMBL22276494 | 0.77 | CA1 (0.38) | PBRM1PARP1CA1CA2CA7 | |
| SCHEMBL30430897 | 0.76 | PBRM1 (0.35) | PBRM1PARP1CA1CA2CA7 |
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-117327058-A | Synthesis method of 7- [ (4, 6-dimethyl-2-pyrimidinyl) thio ] -3-methyl-1 (3H) -isopropyl furanone | 顺毅南通化工有限公司 | 2024-01-02 | — | — | CN | disclosed |