Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCKBR | P32239 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | HTT | P42858 | 5/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 5/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | PKM | P14618 | 3/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | S100A4 | P26447 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | PPARG | P37231 | 2/20 | 0.36 |
| ▸ | NCOA2 | Q15596 | 2/20 | 0.36 |
| ▸ | NCOA1 | Q15788 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | ELANE | P08246 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL30104867 | 0.86 | MAPK1 (0.47) | CCKBRALDH1A1HTTHPGDMAPT | |
| SCHEMBL30104899 | 0.84 | CCKBR (0.38) | CCKBRALDH1A1HTTHPGDMAPT | |
| SCHEMBL30104902 | 0.83 | S100A4 (0.37) | ALDH1A1HTTHPGDMAPTPKM | |
| SCHEMBL30104880 | 0.74 | NUAK1 (0.35) | CCKBRALDH1A1HTTMAPTKDM4E | |
| SCHEMBL30104874 | 0.71 | CCKBR (0.59) | CCKBRALDH1A1MAPTCYP2C19LMNA | |
| SCHEMBL30104840 | 0.69 | NR2E3 (0.37) | CCKBRALDH1A1HTTMAPTS100A4 | |
| SCHEMBL30104872 | 0.69 | POLB (0.38) | CCKBRALDH1A1HPGDS100A4LMNA | |
| SCHEMBL30104893 | 0.68 | CCKBR (0.41) | CCKBRALDH1A1S100A4LMNASMN1; SMN2 | |
| SCHEMBL14505730 | 0.65 | KDM4E (0.40) | CCKBRALDH1A1HTTMAPTGAA | |
| SCHEMBL6153909 | 0.65 | CCKBR (0.59) | CCKBRALDH1A1MAPTCYP2C19LMNA |
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-115583927-B | Thioether compound, and preparation method and application thereof | 华南师范大学 | 2024-07-12 | — | — | CN | disclosed |
| CN-115583927-A | Thioether compound and preparation method and application thereof | 华南师范大学 | 2023-01-10 | — | — | CN | disclosed |