Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.30 |
| ▸ | MMP12 | P39900 | 1/20 | 0.30 |
| ▸ | MMP13 | P45452 | 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 | |
|---|---|---|---|---|
| SCHEMBL17830429 | 0.83 | PKM (0.38) | — | |
| SCHEMBL12985153 | 0.83 | PKM (0.38) | — | |
| SCHEMBL17818301 | 0.79 | ACLY (0.37) | SLC6A2MMP12MMP13 | |
| SCHEMBL17818345 | 0.79 | ACLY (0.37) | SLC6A2MMP12MMP13 | |
| SCHEMBL19989708 | 0.79 | DGAT1 (0.33) | DGAT1SLC6A2MMP12MMP13 | |
| SCHEMBL20001472 | 0.77 | — | — | |
| SCHEMBL20001509 | 0.76 | PAOX (0.33) | — | |
| SCHEMBL28140457 | 0.75 | DGAT1 (0.35) | DGAT1SLC6A2MMP12MMP13 | |
| SCHEMBL27359921 | 0.75 | DGAT1 (0.35) | DGAT1 | |
| SCHEMBL3183165 | 0.75 | DGAT1 (0.35) | DGAT1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109311828-A | Crystalline forms of (R) -4- (5- (cyclopropylethynyl) isoxazol-3-yl) -N-hydroxy-2-methyl-2- (methylsulfonyl) butanamide as antibacterial agents | 诺华股份有限公司 | 2019-02-05 | — | — | CN | disclosed |
| CN-107001295-A | Isoxazole hydroxamic acid compounds as lpxc inhibitors | 诺华股份有限公司 | 2017-08-01 | — | — | CN | disclosed |
| CN-103717582-B | As the different * oxazole derivatives of antiseptic-germicide | PFIZER INC. (US) | 2015-09-30 | — | — | CN | disclosed |