Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 11/20 | 0.67 |
| ▸ | HTR2C | P28335 | 11/20 | 0.67 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.67 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.52 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.52 |
| ▸ | LSS | P48449 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | CA12 | O43570 | 1/20 | 0.49 |
| ▸ | CA1 | P00915 | 1/20 | 0.49 |
| ▸ | CA2 | P00918 | 1/20 | 0.49 |
| ▸ | CA3 | P07451 | 1/20 | 0.49 |
| ▸ | CA4 | P22748 | 1/20 | 0.49 |
| ▸ | CA6 | P23280 | 1/20 | 0.49 |
| ▸ | CA5A | P35218 | 1/20 | 0.49 |
| ▸ | CA7 | P43166 | 1/20 | 0.49 |
| ▸ | CA9 | Q16790 | 1/20 | 0.49 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL14538240 | 0.86 | HTR2A (0.66) | HTR2AHTR2CL3MBTL1SLC6A2SLC6A4 | |
| SCHEMBL3485687 | 0.84 | ALDH1A1 (0.71) | HTR2AHTR2CL3MBTL1SLC6A2SLC6A4 | |
| SCHEMBL231306 | 0.83 | HTR2A (0.46) | HTR2AHTR2CL3MBTL1SLC6A2SLC6A4 | |
| Hydrochloric Acid SCHEMBL27714396 | 0.83 | ALDH1A1 (0.69) | HTR2AHTR2CL3MBTL1SLC6A2SLC6A4 | |
| SCHEMBL13543315 | 0.82 | HTR2A (0.70) | HTR2AHTR2CL3MBTL1SLC6A2SLC6A4 | |
| SCHEMBL29181762 | 0.82 | HTR2C (0.68) | HTR2AHTR2CL3MBTL1SLC6A2SLC6A4 | |
| SCHEMBL29181745 | 0.82 | HTR2A (0.68) | HTR2AHTR2CL3MBTL1SLC6A2SLC6A4 | |
| SCHEMBL29181772 | 0.81 | CA12 (0.53) | HTR2AHTR2CL3MBTL1SLC6A2SLC6A4 | |
| SCHEMBL2338740 | 0.80 | HTR2A (1.00) | HTR2AHTR2CL3MBTL1LSSALDH1A1 | |
| SCHEMBL10194551 | 0.77 | SLC6A4 (0.85) | HTR2AHTR2CSLC6A2SLC6A4ALDH1A1 |
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 |