Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL16616806 | 1.00 | ALDH1A1 (0.33) | ALDH1A1CYP3A4THRBHPGDALOX15 | |
| SCHEMBL29931019 | 0.84 | PDE3B (0.31) | ALDH1A1CYP3A4 | |
| SCHEMBL29446026 | 0.82 | CASP3 (0.35) | ALDH1A1 | |
| SCHEMBL1825576 | 0.82 | CASP3 (0.35) | ALDH1A1 | |
| SCHEMBL20777534 | 0.79 | GLA (0.33) | — | |
| Ammonia Solution, Strong SCHEMBL29552244 | 0.77 | INPPL1 (0.33) | — | |
| Ammonia Solution, Strong SCHEMBL1868935 | 0.77 | INPPL1 (0.33) | — | |
| SCHEMBL10293371 | 0.74 | OPRM1 (0.32) | — | |
| SCHEMBL31119923 | 0.72 | — | — | |
| SCHEMBL665154 | 0.67 | MEN1 (0.39) | ALDH1A1CYP3A4TSHRCASP1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116715629-A | Fluorescent probe for detecting methionine aminopeptidase 1 as well as preparation method and application thereof | 大连医科大学 | 2023-09-08 | — | — | CN | claimed |
| CN-116183572-A | Near infrared fluorescent probe for detecting thioredoxin reductase and application thereof | 大连医科大学附属第二医院 | 2023-05-30 | — | — | CN | claimed |
| CN-116715629-A | Fluorescent probe for detecting methionine aminopeptidase 1 as well as preparation method and application thereof | 大连医科大学 | 2023-09-08 | — | — | CN | disclosed |
| CN-116183572-A | Near infrared fluorescent probe for detecting thioredoxin reductase and application thereof | 大连医科大学附属第二医院 | 2023-05-30 | — | — | CN | disclosed |