Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.74 |
| ▸ | CYP2C9 | P11712 | 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 |
| ▸ | CA12 | O43570 | 1/20 | 0.62 |
| ▸ | CA1 | P00915 | 1/20 | 0.62 |
| ▸ | CA2 | P00918 | 1/20 | 0.62 |
| ▸ | CA9 | Q16790 | 1/20 | 0.62 |
| ▸ | FBP1 | P09467 | 9/20 | 0.60 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.58 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | THRB | P10828 | 1/20 | 0.52 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.52 |
| ▸ | HTR2A | P28223 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL8672470 | 0.87 | ALDH1A1 (0.91) | ALDH1A1CYP2C9LMNATSHRALB | |
| SCHEMBL5931104 | 0.86 | ALDH1A1 (0.79) | ALDH1A1CYP2C9LMNATSHRALB | |
| SCHEMBL29787228 | 0.86 | ALDH1A1 (0.89) | ALDH1A1CYP2C9LMNATSHRALB | |
| SCHEMBL8668492 | 0.86 | ALDH1A1 (0.89) | ALDH1A1CYP2C9LMNATSHRALB | |
| SCHEMBL8668489 | 0.86 | ALDH1A1 (0.89) | ALDH1A1CYP2C9LMNATSHRALB | |
| SCHEMBL23876511 | 0.86 | ALDH1A1 (0.89) | ALDH1A1CYP2C9LMNATSHRALB | |
| SCHEMBL5931121 | 0.86 | ALDH1A1 (0.89) | ALDH1A1CYP2C9LMNATSHRALB | |
| Tolbutamide SCHEMBL15918 | 0.85 | ALDH1A1 (1.00) | ALDH1A1CYP2C9LMNATSHRALB | |
| Tolbutamide SCHEMBL1536920 | 0.85 | ALDH1A1 (1.00) | ALDH1A1CYP2C9LMNATSHRALB | |
| Tolbutamide SCHEMBL11357518 | 0.84 | ALDH1A1 (0.97) | ALDH1A1CYP2C9LMNATSHRALB |
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-112250604-B | Hapten and artificial antigen for broad-spectrum detection of sulfonylurea drugs, antibody and application thereof | 华南农业大学 | 2021-07-20 | — | — | CN | disclosed |
| CN-112250604-A | Hapten and artificial antigen for broad-spectrum detection of sulfonylurea drugs, antibody and application thereof | 华南农业大学 | 2021-01-22 | — | — | CN | disclosed |