Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | KIF11 | P52732 | 1/20 | 0.35 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL6441810 | 0.97 | CA1 (0.42) | CA1CA2KIF11EPHX1ALDH1A1 | |
| SCHEMBL28509262 | 0.95 | CA1 (0.40) | CA1CA2KIF11EPHX1ALDH1A1 | |
| SCHEMBL28497491 | 0.95 | CA1 (0.40) | CA1CA2KIF11EPHX1ALDH1A1 | |
| SCHEMBL6466289 | 0.83 | CA1 (0.39) | CA1CA2KIF11ALDH1A1 | |
| Trimethylammonium SCHEMBL29395692 | 0.81 | CA2 (0.46) | CA1CA2KIF11EPHX1PTPN11 | |
| SCHEMBL414807 | 0.78 | CA2 (0.53) | CA1CA2EPHX1PTPN11 | |
| SCHEMBL2290498 | 0.78 | CA2 (0.53) | CA1CA2EPHX1PTPN11 | |
| SCHEMBL28489693 | 0.78 | EPHX1 (0.37) | CA1CA2EPHX1 | |
| SCHEMBL28489243 | 0.78 | EPHX1 (0.37) | CA1CA2EPHX1 | |
| Fluoride SCHEMBL22801398 | 0.75 | CA2 (0.50) | CA1CA2EPHX1PTPN11 |
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-112110836-A | Salts having anions with non-fluorinated dialkylaminosulfonyl and/or sulfinyl imino groups and with perfluoroalkylsulfonyl groups | 罗伯特·博世有限公司 | 2020-12-22 | — | — | CN | disclosed |