Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 4/20 | 0.36 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | CA7 | P43166 | 1/20 | 0.30 |
| ▸ | CA9 | Q16790 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL31010991 | 0.89 | ACHE (0.39) | ACHETSHRLMNAALOX12TDP1 | |
| SCHEMBL3888490 | 0.87 | ACHE (0.39) | ACHETSHRLMNAALOX12TDP1 | |
| SCHEMBL235850 | 0.82 | TSHR (0.47) | ACHETSHRLMNAALOX12TDP1 | |
| SCHEMBL29468607 | 0.82 | TSHR (0.47) | ACHETSHRLMNAALOX12TDP1 | |
| SCHEMBL8933405 | 0.81 | KEAP1 (0.41) | ACHELMNATDP1ALDH1A1CA1 | |
| SCHEMBL29587400 | 0.81 | TSHR (0.31) | ACHETSHR | |
| SCHEMBL21055989 | 0.80 | ALDH1A1 (0.37) | ACHETSHRLMNAALOX12TDP1 | |
| SCHEMBL21055988 | 0.80 | ALDH1A1 (0.37) | ACHETSHRLMNAALOX12TDP1 | |
| SCHEMBL6912793 | 0.80 | TDP1 (0.39) | ACHETSHRLMNAALOX12TDP1 | |
| SCHEMBL20955826 | 0.80 | TSHR (0.30) | ACHETSHR |
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-109535046-B | Preparation method of sulfoxide compound | 江南大学 | 2020-01-17 | — | — | CN | disclosed |
| CN-109535046-A | A kind of preparation method of sulfoxide compound | 江南大学 | 2019-03-29 | — | — | CN | disclosed |