Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACLY | P53396 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | MMP12 | P39900 | 1/20 | 0.33 |
| ▸ | MMP13 | P45452 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL12984992 | 1.00 | ACLY (0.34) | ACLYSLC6A2MMP12MMP13 | |
| SCHEMBL12984995 | 1.00 | ACLY (0.34) | ACLYSLC6A2MMP12MMP13 | |
| SCHEMBL17818330 | 1.00 | ACLY (0.34) | ACLYSLC6A2MMP12MMP13 | |
| SCHEMBL17818350 | 1.00 | ACLY (0.34) | ACLYSLC6A2MMP12MMP13 | |
| SCHEMBL15422497 | 0.81 | ACLY (0.36) | ACLYSLC6A2MMP12MMP13 | |
| SCHEMBL17847935 | 0.81 | ACLY (0.36) | ACLYSLC6A2MMP12MMP13 | |
| SCHEMBL17818345 | 0.79 | ACLY (0.37) | ACLYSLC6A2MMP12MMP13 | |
| SCHEMBL17818301 | 0.79 | ACLY (0.37) | ACLYSLC6A2MMP12MMP13 | |
| SCHEMBL12985378 | 0.79 | PKM (0.36) | — | |
| SCHEMBL13192842 | 0.79 | PKM (0.36) | — |
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-107001295-B | Isoxazole hydroxamic acid compounds as LpxC inhibitors | 诺华股份有限公司 | 2021-02-02 | — | — | CN | disclosed |