Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 5/20 | 0.47 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.47 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | CASR | P41180 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | HTR2C | P28335 | 1/20 | 0.37 |
| ▸ | HTR2B | P41595 | 1/20 | 0.37 |
| ▸ | KIF11 | P52732 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL24760389 | 0.74 | CYP3A4 (0.44) | SLC6A2CYP3A4CYP2D6SLC6A4SLC6A3 | |
| SCHEMBL10867877 | 0.73 | PTPN1 (0.45) | SLC6A2CYP3A4CYP2D6SLC6A4SLC6A3 | |
| SCHEMBL9274665 | 0.73 | CASR (0.46) | SLC6A2CYP3A4CYP2D6SLC6A4SLC6A3 | |
| Hydrochloric Acid SCHEMBL7600560 | 0.73 | SLC6A2 (0.43) | SLC6A2CYP3A4CYP2D6SLC6A4SLC6A3 | |
| SCHEMBL17775053 | 0.73 | CYP1A2 (0.47) | SLC6A2TAAR1CYP3A4CYP2D6SLC6A4 | |
| Hydrochloric Acid SCHEMBL12802175 | 0.71 | CASR (0.45) | SLC6A2CYP3A4CYP2D6SLC6A4SLC6A3 | |
| SCHEMBL8323216 | 0.70 | SLC6A2 (0.46) | SLC6A2TAAR1CYP3A4CYP2D6SLC6A4 | |
| SCHEMBL3983284 | 0.70 | CASR (0.44) | SLC6A2CYP3A4CYP2D6SLC6A4SLC6A3 | |
| SCHEMBL4069694 | 0.70 | CASR (0.44) | SLC6A2CYP3A4CYP2D6SLC6A4SLC6A3 | |
| SCHEMBL3984307 | 0.70 | CASR (0.44) | SLC6A2CYP3A4CYP2D6SLC6A4SLC6A3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2234960-A2 | INHIBITING NEUROTRANSMITTER REUPTAKE | Mayo Foundation for Medical Education and Research (US) | 2010-10-06 | — | — | EP | claimed |
| WO-2009089479-A2 | INHIBITING NEUROTRANSMITTER REUPTAKE | MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) | 2009-07-16 | — | — | WO | claimed |
| EP-2234960-A2 | INHIBITING NEUROTRANSMITTER REUPTAKE | Mayo Foundation for Medical Education and Research (US) | 2010-10-06 | — | — | EP | disclosed |
| WO-2009089479-A2 | INHIBITING NEUROTRANSMITTER REUPTAKE | MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) | 2009-07-16 | — | — | WO | disclosed |