Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.55 |
| ▸ | CA12 | O43570 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | CA7 | P43166 | 1/20 | 0.50 |
| ▸ | CA9 | Q16790 | 1/20 | 0.50 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.50 |
| ▸ | AR | P10275 | 5/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | BACE1 | P56817 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.44 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL26394168 | 0.89 | ALDH1A1 (0.61) | ACHEALDH1A1CYP3A4CA12CA1 | |
| SCHEMBL22925860 | 0.83 | ACHE (0.64) | ACHEALDH1A1CYP3A4CA12CA1 | |
| SCHEMBL9517940 | 0.82 | ALDH1A1 (0.66) | ALDH1A1CYP3A4CA12CA1CA2 | |
| SCHEMBL10999189 | 0.82 | TEAD4 (0.54) | ACHEALDH1A1CYP3A4ARGAA | |
| SCHEMBL12474539 | 0.82 | ALDH1A1 (0.51) | ALDH1A1CYP3A4CA12CA1CA2 | |
| SCHEMBL5583756 | 0.81 | ALDH1A1 (0.63) | ACHEALDH1A1CYP3A4ARGAA | |
| SCHEMBL5583654 | 0.80 | TEAD4 (0.57) | ALDH1A1CYP3A4ARGAAMEN1 | |
| SCHEMBL22925857 | 0.80 | ACHE (0.60) | ACHEALDH1A1CYP3A4CA12CA1 | |
| SCHEMBL91459 | 0.80 | ALDH1A1 (0.68) | ACHEALDH1A1CYP3A4GAAMAPT | |
| SCHEMBL30294328 | 0.80 | ALDH1A1 (0.68) | ACHEALDH1A1CYP3A4GAAMAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110330477-B | Phenyl thiophene sulfonamide compound, pharmaceutical composition, preparation method and application thereof | 中国科学院上海有机化学研究所 | 2021-03-23 | — | — | CN | disclosed |
| WO-2021012689-A1 | PHENYLTHIOPHENE SULFONAMIDE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, PREPARATION METHOD THEREFOR AND USE THEREOF | 中国科学院上海有机化学研究所 | 2021-01-28 | — | — | WO | disclosed |
| WO-2021012689-A1 | PHENYLTHIOPHENE SULFONAMIDE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, PREPARATION METHOD THEREFOR AND USE THEREOF | 中国科学院上海有机化学研究所 | 2021-01-28 | — | — | WO | disclosed |