Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMPD1 | P17405 | 3/20 | 0.33 |
| ▸ | PGK1 | P00558 | 1/20 | 0.32 |
| ▸ | PGK2 | P07205 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | MMP1 | P03956 | 1/20 | 0.31 |
| ▸ | MMP2 | P08253 | 1/20 | 0.31 |
| ▸ | MMP9 | P14780 | 1/20 | 0.31 |
| ▸ | MMP8 | P22894 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | FDPS | P14324 | 1/20 | 0.30 |
| ▸ | BLM | P54132 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL183389 | 0.97 | SMPD1 (0.34) | SMPD1PGK1PGK2CA12CA1 | |
| SCHEMBL1840428 | 0.77 | PGK1 (0.38) | SMPD1PGK1PGK2TDP1 | |
| SCHEMBL9952548 | 0.77 | PGK1 (0.38) | SMPD1PGK1PGK2TDP1 | |
| SCHEMBL19281218 | 0.77 | PGK1 (0.38) | SMPD1PGK1PGK2TDP1 | |
| SCHEMBL26913628 | 0.75 | PGK1 (0.37) | SMPD1PGK1PGK2TDP1 | |
| SCHEMBL27241907 | 0.75 | PGK1 (0.37) | SMPD1PGK1PGK2TDP1 | |
| SCHEMBL11522192 | 0.75 | CA4 (0.40) | SMPD1CA12CA1CA2MMP1 | |
| SCHEMBL13176812 | 0.75 | SMPD1 (0.33) | SMPD1FDPSBLMTDP1 | |
| SCHEMBL13702105 | 0.75 | SMPD1 (0.33) | SMPD1FDPSBLMTDP1 | |
| SCHEMBL2304452 | 0.75 | TSHR (0.33) | SMPD1TSHR |
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-110305913-A | A kind of method of saccharine material production Tetramethylpyrazine | 山东省食品发酵工业研究设计院 | 2019-10-08 | — | — | CN | disclosed |