Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.74 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.74 |
| ▸ | LMNA | P02545 | 2/20 | 0.74 |
| ▸ | TSHR | P16473 | 2/20 | 0.74 |
| ▸ | ALB | P02768 | 1/20 | 0.74 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.74 |
| ▸ | FBP1 | P09467 | 12/20 | 0.71 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.58 |
| ▸ | THRB | P10828 | 1/20 | 0.58 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.58 |
| ▸ | HTR2A | P28223 | 1/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.58 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.58 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.58 |
| ▸ | CA12 | O43570 | 1/20 | 0.56 |
| ▸ | CA1 | P00915 | 1/20 | 0.56 |
| ▸ | CA2 | P00918 | 1/20 | 0.56 |
| ▸ | CA9 | Q16790 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL184964 | 0.98 | CYP2C9 (0.76) | CYP2C9ALDH1A1LMNATSHRALB | |
| SCHEMBL11049679 | 0.94 | CYP2C9 (0.69) | CYP2C9ALDH1A1LMNATSHRALB | |
| SCHEMBL19271872 | 0.93 | EPHX2 (0.68) | CYP2C9ALDH1A1LMNATSHRALB | |
| SCHEMBL28534045 | 0.93 | EPHX2 (0.68) | CYP2C9ALDH1A1LMNATSHRALB | |
| SCHEMBL6464356 | 0.90 | CYP2C9 (0.72) | CYP2C9ALDH1A1LMNATSHRALB | |
| SCHEMBL2290886 | 0.89 | ALDH1A1 (0.72) | CYP2C9ALDH1A1LMNATSHRALB | |
| SCHEMBL5931108 | 0.87 | FBP1 (0.70) | CYP2C9ALDH1A1LMNATSHRALB | |
| Tolbutamide SCHEMBL28046582 | 0.87 | ALDH1A1 (0.97) | CYP2C9ALDH1A1LMNATSHRALB | |
| SCHEMBL1478625 | 0.85 | CYP2C9 (0.74) | CYP2C9ALDH1A1LMNATSHRALB | |
| Tolbutamide SCHEMBL15918 | 0.85 | ALDH1A1 (1.00) | CYP2C9ALDH1A1LMNATSHRALB |
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-109010844-A | One kind is according to Shandong for Buddhist nun's phosphatide complexes and preparation method thereof | 沈阳药科大学 | 2018-12-18 | — | — | CN | disclosed |