Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGAM | O43451 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | SI | P14410 | 1/20 | 0.44 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.41 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.38 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL76382 | 0.91 | — | — | |
| SCHEMBL54111 | 0.91 | — | — | |
| SCHEMBL434191 | 0.91 | — | — | |
| Succinic Acid SCHEMBL29021088 | 0.90 | MGAM (0.43) | MGAMGAASIMGAM2ALDH1A1 | |
| SCHEMBL27522306 | 0.89 | — | — | |
| SCHEMBL27668114 | 0.89 | MGAM (0.50) | MGAMGAASIMGAM2ALDH1A1 | |
| Malic Acid SCHEMBL29124821 | 0.89 | SMN1; SMN2 (0.54) | MGAMGAASIMGAM2ALDH1A1 | |
| Lactic Acid SCHEMBL29124782 | 0.88 | TP53 (0.46) | MGAMGAASIMGAM2ALDH1A1 | |
| Formaldehyde SCHEMBL5845336 | 0.87 | MGAM (0.48) | MGAMGAASIMGAM2ALDH1A1 | |
| SCHEMBL5866612 | 0.87 | MGAM (0.48) | MGAMGAASIMGAM2ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112516127-A | Application of joint use of hydroxytyrosol acetate and beta-hydroxybutyric acid ethyl ester in preparation of health-care food and medicine for relieving brain fatigue | 西安交通大学 | 2021-03-19 | — | — | CN | disclosed |
| CN-109796326-A | A kind of preparation method of 3-hydroxybutyrate salt | 宣城菁科生物科技有限公司 | 2019-05-24 | — | — | CN | disclosed |