Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | C3AR1 | Q16581 | 1/20 | 0.42 |
| ▸ | NOD1 | Q9Y239 | 4/20 | 0.41 |
| ▸ | ITGB3 | P05106 | 4/20 | 0.40 |
| ▸ | ITGA2B | P08514 | 4/20 | 0.40 |
| ▸ | NPY4R | P50391 | 6/20 | 0.39 |
| ▸ | NPY5R | Q15761 | 6/20 | 0.39 |
| ▸ | NPY1R | P25929 | 5/20 | 0.39 |
| ▸ | NPY2R | P49146 | 3/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | GNPAT | O15228 | 1/20 | 0.38 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.38 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28531459 | 1.00 | C3AR1 (0.42) | C3AR1NOD1ITGB3ITGA2BNPY4R | |
| SCHEMBL16359356 | 0.90 | NPY4R (0.44) | NOD1ITGB3ITGA2BNPY4RNPY5R | |
| SCHEMBL23408816 | 0.90 | ITGB3 (0.46) | C3AR1NOD1ITGB3ITGA2BNPY4R | |
| SCHEMBL20539114 | 0.84 | NOD1 (0.47) | C3AR1NOD1NPY4RNPY5RNPY1R | |
| SCHEMBL18765407 | 0.84 | NOD1 (0.47) | C3AR1NOD1NPY4RNPY5RNPY1R | |
| SCHEMBL2338925 | 0.84 | C3AR1 (0.47) | C3AR1NOD1NPY4RNPY5RNPY1R | |
| SCHEMBL2338931 | 0.84 | C3AR1 (0.47) | C3AR1NOD1NPY4RNPY5RNPY1R | |
| SCHEMBL21261703 | 0.82 | FOLH1 (0.48) | NOD1HDAC2FOLH1 | |
| SCHEMBL187696 | 0.82 | C3AR1 (0.45) | C3AR1NOD1NPY4RNPY5RNPY1R | |
| SCHEMBL2116832 | 0.82 | C3AR1 (0.45) | C3AR1NOD1NPY4RNPY5RNPY1R |
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-108017555-B | Beta-hydroxybutyryl-amino acid compound and preparation method and application thereof | 郑州海斯威生物技术有限公司 | 2021-03-26 | — | — | CN | disclosed |