Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 2/20 | 0.43 |
| ▸ | CAMK2A | Q9UQM7 | 1/20 | 0.43 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA3 | P07451 | 1/20 | 0.38 |
| ▸ | TYR | P14679 | 1/20 | 0.38 |
| ▸ | DRD1 | P21728 | 1/20 | 0.38 |
| ▸ | CA4 | P22748 | 1/20 | 0.38 |
| ▸ | CA6 | P23280 | 1/20 | 0.38 |
| ▸ | CA5A | P35218 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.38 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | ESRRG | P62508 | 3/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL13645018 | 0.91 | CA2 (0.46) | CA2CAMK2ACYP1A1CA12CA1 | |
| SCHEMBL8483627 | 0.84 | ESRRG (0.48) | CA2CAMK2ATDP1ALDH1A1ESRRG | |
| SCHEMBL547411 | 0.83 | TDP1 (0.47) | TDP1ALDH1A1POLBGAAL3MBTL1 | |
| SCHEMBL13644973 | 0.82 | CA2 (0.42) | CA2CAMK2ACYP1A1CA12CA1 | |
| SCHEMBL8038936 | 0.82 | TDP1 (0.44) | DRD1TDP1ALDH1A1KDM4EBLM | |
| SCHEMBL2985103 | 0.80 | CA2 (0.37) | CA2CAMK2ACYP1A1CA12CA1 | |
| SCHEMBL11297196 | 0.78 | CA2 (0.46) | CA2CAMK2ACYP1A1CA12CA1 | |
| SCHEMBL13645000 | 0.78 | CYP1A1 (0.41) | CA2CAMK2ACYP1A1ALDH1A1ESRRG | |
| SCHEMBL13603850 | 0.78 | ALDH1A1 (0.40) | CA2CAMK2ACYP1A1CA12CA1 | |
| SCHEMBL7643003 | 0.77 | PLA2G2A (0.46) | ALDH1A1ESRRGPOLBGAAKDM4E |
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-109400491-B | Crystallization preparation method of L-p-hydroxyphenylglycine methyl ester | 威海海洋职业学院 | 2021-03-23 | — | — | CN | claimed |