Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.80 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.73 |
| ▸ | POLB | P06746 | 1/20 | 0.73 |
| ▸ | HTT | P42858 | 1/20 | 0.72 |
| ▸ | GAA | P10253 | 2/20 | 0.66 |
| ▸ | MAPT | P10636 | 2/20 | 0.66 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.66 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.65 |
| ▸ | GLA | P06280 | 1/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.63 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.61 |
| ▸ | LMNA | P02545 | 1/20 | 0.60 |
| ▸ | PKM | P14618 | 1/20 | 0.60 |
| ▸ | HPGD | P15428 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL28352130 | 0.97 | CYP2C9 (0.80) | CYP2C9ALDH1A1POLBHTTGAA | |
| SCHEMBL12793847 | 0.96 | CYP2C9 (0.78) | CYP2C9ALDH1A1POLBHTTGAA | |
| SCHEMBL28352182 | 0.86 | HTT (0.77) | CYP2C9ALDH1A1POLBHTTGAA | |
| SCHEMBL6791735 | 0.84 | CYP2C9 (0.69) | CYP2C9ALDH1A1POLBHTTGAA | |
| SCHEMBL10900999 | 0.83 | CYP2C9 (0.71) | CYP2C9ALDH1A1POLBHTTGAA | |
| SCHEMBL10901799 | 0.81 | CYP2C9 (0.68) | CYP2C9ALDH1A1POLBHTTGAA | |
| SCHEMBL10902432 | 0.80 | CYP2C9 (0.67) | CYP2C9ALDH1A1POLBHTTGAA | |
| SCHEMBL10900411 | 0.79 | CYP2C9 (0.69) | CYP2C9ALDH1A1POLBHTTGAA | |
| SCHEMBL11292601 | 0.79 | KMT2A (0.64) | CYP2C9ALDH1A1POLBHTTGAA | |
| SCHEMBL9436741 | 0.79 | GLA (1.00) | ALDH1A1POLBHTTMAPTADRB2 |
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-110759889-B | 2-aryl amido substituted thiophene imide ester compound and preparation method and application thereof | 中国医学科学院药物研究所 | 2022-05-20 | — | — | CN | disclosed |
| CN-110759889-A | 2-aryl amido substituted thiophene imide ester compound and preparation method and application thereof | 中国医学科学院药物研究所 | 2020-02-07 | — | — | CN | disclosed |