Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL28908835 | 0.89 | EPHX1 (0.38) | EPHX1 | |
| SCHEMBL2245757 | 0.85 | ALDH1A1 (0.41) | DUT | |
| SCHEMBL592816 | 0.85 | ALDH1A1 (0.41) | DUT | |
| SCHEMBL2223898 | 0.85 | ALDH1A1 (0.41) | DUT | |
| SCHEMBL591257 | 0.80 | ALDH1A1 (0.44) | DUT | |
| SCHEMBL336309 | 0.79 | ALDH1A1 (0.47) | EPHX1DUT | |
| SCHEMBL335223 | 0.79 | ALDH1A1 (0.47) | EPHX1DUT | |
| SCHEMBL30209271 | 0.77 | ALDH1A1 (0.34) | EPHX1 | |
| SCHEMBL14513917 | 0.77 | SLC6A4 (0.35) | EPHX1DUT | |
| SCHEMBL14513913 | 0.77 | SLC6A4 (0.35) | EPHX1DUT |
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-115298176-A | Compounds and their use in the treatment of bacterial infections | 豪夫迈·罗氏有限公司 | 2022-11-04 | — | — | CN | disclosed |