Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 3/20 | 0.32 |
| ▸ | CA2 | P00918 | 3/20 | 0.32 |
| ▸ | CA7 | P43166 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | FBP1 | P09467 | 1/20 | 0.30 |
| ▸ | IDO1 | P14902 | 1/20 | 0.30 |
| ▸ | TDO2 | P48775 | 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 | |
|---|---|---|---|---|
| SCHEMBL13851039 | 0.78 | ACHE (0.36) | CA1CA2CA7CA9ACHE | |
| SCHEMBL776881 | 0.77 | — | — | |
| SCHEMBL19567347 | 0.73 | ALDH1A1 (0.36) | CA1CA2CA9 | |
| SCHEMBL28379149 | 0.73 | CA1 (0.46) | CA1CA2CA7CA9ACHE | |
| SCHEMBL776183 | 0.73 | CA1 (0.38) | CA1CA2CA7CA9ACHE | |
| SCHEMBL16555573 | 0.70 | VCP (0.34) | — | |
| SCHEMBL11754390 | 0.69 | MMP1 (0.39) | CA1CA2 | |
| SCHEMBL19823499 | 0.69 | LOXL2 (0.36) | CA1CA2CA7CA9ACHE | |
| SCHEMBL14467510 | 0.69 | ACHE (0.41) | CA1CA2CA7CA9ACHE | |
| SCHEMBL13823044 | 0.69 | CA1 (0.35) | CA1CA2CA7CA9ACHE |
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-110981768-A | Simple synthesis method of aryl difluoroalkyl sulfoxide compound | 山东理工大学 | 2020-04-10 | — | — | CN | disclosed |
| CN-105530923-A | Aryl ethers and their use | PELOTON THERAPEUTICS INC | 2016-04-27 | — | — | CN | disclosed |