Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 6/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | TP53 | P04637 | 4/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.30 |
| ▸ | THRA | P10827 | 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 | |
|---|---|---|---|---|
| SCHEMBL4195636 | 0.84 | TSHR (0.48) | THRBTSHRALDH1A1TP53HIF1A | |
| SCHEMBL11316113 | 0.83 | THRB (0.38) | THRBTSHRALDH1A1TP53HIF1A | |
| SCHEMBL28174969 | 0.77 | ALDH1A1 (0.51) | ALDH1A1TP53CYP3A4HSD17B10SMN1; SMN2 | |
| SCHEMBL29577996 | 0.74 | THRB (0.53) | THRBTSHRALDH1A1TP53HIF1A | |
| SCHEMBL10451653 | 0.74 | THRB (0.53) | THRBTSHRALDH1A1TP53HIF1A | |
| SCHEMBL397704 | 0.71 | ALDH1A1 (0.62) | THRBTSHRALDH1A1TP53HSD17B10 | |
| SCHEMBL1591973 | 0.71 | MAOB (0.46) | THRBTSHRALDH1A1HPGDTHRA | |
| SCHEMBL27421526 | 0.70 | THRB (0.45) | THRBTSHRALDH1A1TP53HIF1A | |
| SCHEMBL2556244 | 0.70 | HCAR2 (0.50) | THRBTSHRALDH1A1TP53HIF1A | |
| SCHEMBL28105501 | 0.70 | ALDH1A1 (0.60) | THRBTSHRALDH1A1TP53HSD17B10 |
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-117229507-A | Method for synthesizing macromolecule with main chain containing thiocarbamate group and product thereof | 浙江大学 | 2023-12-15 | — | — | CN | disclosed |