Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 6/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.50 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.50 |
| ▸ | TSHR | P16473 | 3/20 | 0.50 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.50 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.50 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.50 |
| ▸ | HTR2A | P28223 | 2/20 | 0.50 |
| ▸ | HTR2C | P28335 | 2/20 | 0.50 |
| ▸ | HRH1 | P35367 | 2/20 | 0.50 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.50 |
| ▸ | DRD3 | P35462 | 2/20 | 0.50 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.50 |
| ▸ | HTR2B | P41595 | 2/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.50 |
| ▸ | KLF10 | Q13118 | 2/20 | 0.50 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL5029640 | 1.00 | SLC6A2 (0.50) | SLC6A2CYP1A2CYP3A4CYP2D6SLC6A4 | |
| SCHEMBL4941291 | 0.81 | SLC6A4 (0.47) | SLC6A2CYP1A2CYP3A4CYP2D6SLC6A4 | |
| SCHEMBL8502073 | 0.79 | LMNA (0.41) | SLC6A2CYP3A4CYP2D6SLC6A4SLC6A3 | |
| SCHEMBL9411489 | 0.75 | SLC6A9 (0.47) | SLC6A2CYP1A2CYP3A4CYP2D6SLC6A4 | |
| SCHEMBL4106328 | 0.75 | SLC6A2 (0.54) | SLC6A2CYP1A2CYP3A4CYP2D6SLC6A4 | |
| SCHEMBL7999771 | 0.74 | SLC6A2 (0.57) | SLC6A2CYP1A2CYP3A4CYP2D6SLC6A4 | |
| Atomoxetine SCHEMBL4730438 | 0.74 | SLC6A4 (0.78) | SLC6A2CYP1A2CYP3A4CYP2D6SLC6A4 | |
| Atomoxetine SCHEMBL4943829 | 0.74 | SLC6A4 (0.78) | SLC6A2CYP1A2CYP3A4CYP2D6SLC6A4 | |
| Atomoxetine SCHEMBL10523421 | 0.74 | SLC6A4 (0.78) | SLC6A2CYP1A2CYP3A4CYP2D6SLC6A4 | |
| SCHEMBL5037911 | 0.74 | SLC6A2 (0.36) | SLC6A2CYP1A2CYP3A4CYP2D6SLC6A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1794112-A1 | SYNTHESIS OF ATOMOXETINE HYDROCHLORIDE | Dr. Reddy's Laboratories Ltd. (IN) | 2007-06-13 | — | — | EP | disclosed |
| WO-2006037055-A1 | SYNTHESIS OF ATOMOXETINE HYDROCHLORIDE | DR. REDDY'S LABORATORIES LTD. (IN) | 2006-04-06 | — | — | WO | disclosed |
| WO-2006009884-A1 | 3-ARYLOXY-3-ARYLPROPYLAMINE SYNTHESIS | DR. REDDY'S LABORATORIES LTD. (IN) | 2006-01-26 | — | — | WO | disclosed |