Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A12 | Q96S37 | 2/20 | 0.50 |
| ▸ | XDH | P47989 | 1/20 | 0.50 |
| ▸ | HPGDS | O60760 | 1/20 | 0.45 |
| ▸ | F11 | P03951 | 1/20 | 0.44 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.44 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.44 |
| ▸ | PDE4A | P27815 | 1/20 | 0.43 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.43 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.43 |
| ▸ | FNTA | P49354 | 1/20 | 0.43 |
| ▸ | FNTB | P49356 | 1/20 | 0.43 |
| ▸ | BACE1 | P56817 | 1/20 | 0.42 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.42 |
| ▸ | EIF4E | P06730 | 1/20 | 0.42 |
| ▸ | GSK3B | P49841 | 2/20 | 0.41 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.41 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.41 |
| ▸ | MMP12 | P39900 | 1/20 | 0.40 |
| ▸ | MMP13 | P45452 | 1/20 | 0.40 |
| ▸ | PRF1 | P14222 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28645733 | 1.00 | SLC22A12 (0.50) | SLC22A12XDHHPGDSF11PIN1 | |
| SCHEMBL938500 | 0.82 | KMO (0.52) | — | |
| SCHEMBL12945924 | 0.79 | SLC6A7 (0.48) | BACE1 | |
| SCHEMBL5529069 | 0.78 | XDH (0.62) | SLC22A12XDHF11PIN1CLK4 | |
| SCHEMBL7803345 | 0.76 | XDH (0.60) | SLC22A12XDHF11PIN1CLK4 | |
| SCHEMBL29788150 | 0.76 | XDH (0.65) | SLC22A12XDHCLK4PDE4APDE4C | |
| SCHEMBL2034067 | 0.76 | XDH (0.65) | SLC22A12XDHCLK4PDE4APDE4C | |
| SCHEMBL24952187 | 0.75 | ALDH1A1 (0.57) | XDHPIN1 | |
| SCHEMBL20746116 | 0.75 | HPGDS (0.65) | SLC22A12XDHHPGDSFNTAFNTB | |
| SCHEMBL27711670 | 0.75 | BACE1 (0.43) | SLC22A12XDHHPGDSCLK4BACE1 |
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-113444081-B | Thiadiazole carboxamide compounds and application thereof | 浙江大学 | 2022-07-05 | — | — | CN | disclosed |