Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 1/20 | 0.70 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.69 |
| ▸ | HTR2A | P28223 | 2/20 | 0.66 |
| ▸ | HTR2C | P28335 | 1/20 | 0.66 |
| ▸ | HTR2B | P41595 | 1/20 | 0.66 |
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 | |
|---|---|---|---|---|
| SCHEMBL13484409 | 1.00 | SLC6A4 (0.70) | SLC6A4TAAR1HTR2AHTR2CHTR2B | |
| Hydrochloric Acid SCHEMBL11281141 | 0.98 | SLC6A4 (0.68) | SLC6A4TAAR1HTR2AHTR2CHTR2B | |
| SCHEMBL13484112 | 0.85 | PTGS1 (0.54) | SLC6A4TAAR1 | |
| Hydrochloric Acid SCHEMBL11282729 | 0.83 | HTR2A (0.62) | SLC6A4TAAR1HTR2AHTR2CHTR2B | |
| Para-Methoxyamphetamine SCHEMBL264634 | 0.83 | SLC6A4 (1.00) | SLC6A4TAAR1 | |
| Para-Methoxyamphetamine SCHEMBL394418 | 0.83 | SLC6A4 (1.00) | SLC6A4TAAR1 | |
| Para-Methoxyamphetamine SCHEMBL895775 | 0.83 | SLC6A4 (1.00) | SLC6A4TAAR1 | |
| SCHEMBL9546449 | 0.82 | PTGS1 (0.56) | TAAR1 | |
| SCHEMBL9546445 | 0.82 | PTGS1 (0.56) | TAAR1 | |
| SCHEMBL30824303 | 0.82 | PTGS1 (0.56) | SLC6A4TAAR1 |
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-113683535-B | Compound containing cyanoguanidine structure and preparation method and application thereof | 中国药科大学 | 2022-08-30 | — | — | CN | disclosed |