Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 10/20 | 0.57 |
| ▸ | SLC6A4 | P31645 | 6/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.57 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.57 |
| ▸ | TSHR | P16473 | 3/20 | 0.57 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.57 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.57 |
| ▸ | HTR2A | P28223 | 2/20 | 0.57 |
| ▸ | HTR2C | P28335 | 2/20 | 0.57 |
| ▸ | HRH1 | P35367 | 2/20 | 0.57 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.57 |
| ▸ | DRD3 | P35462 | 2/20 | 0.57 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.57 |
| ▸ | HTR2B | P41595 | 2/20 | 0.57 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.57 |
| ▸ | KLF10 | Q13118 | 2/20 | 0.57 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL14307123 | 0.80 | SLC6A2 (0.66) | SLC6A2SLC6A4CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL17694756 | 0.80 | SLC6A2 (0.66) | SLC6A2SLC6A4CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL10064914 | 0.80 | SLC6A2 (0.66) | SLC6A2SLC6A4CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL5280203 | 0.78 | SLC6A2 (0.64) | SLC6A2SLC6A4CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL28840369 | 0.78 | SLC6A2 (0.68) | SLC6A2SLC6A4CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL28840368 | 0.78 | SLC6A2 (0.68) | SLC6A2SLC6A4CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL8622280 | 0.77 | SLC6A2 (0.52) | SLC6A2SLC6A4CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL28873540 | 0.77 | SLC6A2 (0.58) | SLC6A2SLC6A4CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL5281911 | 0.76 | SLC6A2 (0.54) | SLC6A2SLC6A4CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL5281918 | 0.76 | SLC6A2 (0.54) | SLC6A2SLC6A4CYP1A2CYP3A4CYP2D6 |
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-109706191-B | Enzyme catalytic synthesis method of tomoxetine intermediate | 南京欧信医药技术有限公司 | 2022-09-09 | — | — | CN | disclosed |