Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 12/20 | 0.68 |
| ▸ | HTR2C | P28335 | 11/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.68 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.68 |
| ▸ | GAA | P10253 | 2/20 | 0.68 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.53 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.53 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | MMP1 | P03956 | 1/20 | 0.44 |
| ▸ | MMP2 | P08253 | 1/20 | 0.44 |
| ▸ | MMP3 | P08254 | 1/20 | 0.44 |
| ▸ | MMP7 | P09237 | 1/20 | 0.44 |
| ▸ | MMP9 | P14780 | 1/20 | 0.44 |
| ▸ | MMP8 | P22894 | 1/20 | 0.44 |
| ▸ | MMP13 | P45452 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL13979925 | 0.85 | ALDH1A1 (0.72) | HTR2AHTR2CALDH1A1L3MBTL1GAA | |
| SCHEMBL14538240 | 0.83 | HTR2A (0.66) | HTR2AHTR2CALDH1A1L3MBTL1GAA | |
| SCHEMBL29181773 | 0.82 | HTR2A (0.67) | HTR2AHTR2CALDH1A1L3MBTL1GAA | |
| SCHEMBL3557754 | 0.82 | SLC6A2 (0.56) | HTR2AHTR2CALDH1A1L3MBTL1GAA | |
| SCHEMBL3485687 | 0.81 | ALDH1A1 (0.71) | HTR2AHTR2CALDH1A1L3MBTL1GAA | |
| SCHEMBL5371501 | 0.81 | TSHR (0.63) | HTR2AHTR2CALDH1A1L3MBTL1GAA | |
| Hydrochloric Acid SCHEMBL27714396 | 0.80 | ALDH1A1 (0.69) | HTR2AHTR2CALDH1A1L3MBTL1GAA | |
| Bicarbonate SCHEMBL2492631 | 0.80 | ALDH1A1 (0.65) | HTR2AHTR2CALDH1A1L3MBTL1GAA | |
| SCHEMBL3556156 | 0.80 | SLC6A2 (0.58) | HTR2AHTR2CALDH1A1L3MBTL1GAA | |
| SCHEMBL29181762 | 0.79 | HTR2C (0.68) | HTR2AHTR2CALDH1A1L3MBTL1SLC6A2 |
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-117645567-A | Chalcone derivative containing piperidine sulfonamide structure, and preparation method and application thereof | 贵州大学 | 2024-03-05 | — | — | CN | disclosed |