Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 16/20 | 0.51 |
| ▸ | SLC6A3 | Q01959 | 15/20 | 0.51 |
| ▸ | SLC6A2 | P23975 | 7/20 | 0.47 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.47 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.47 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.47 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.47 |
| ▸ | HTR2A | P28223 | 1/20 | 0.47 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.47 |
| ▸ | HTR2B | P41595 | 1/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9864262 | 0.87 | SLC6A4 (0.55) | SLC6A4SLC6A3SLC6A2CHRM2ADRA2A | |
| Hydrochloric Acid SCHEMBL9864430 | 0.86 | CYP3A4 (0.56) | SLC6A4SLC6A3SLC6A2CHRM2ADRA2A | |
| SCHEMBL9864344 | 0.74 | SLC6A3 (0.40) | SLC6A4SLC6A3SLC6A2CHRM2ADRA2A | |
| SCHEMBL9864183 | 0.74 | SLC6A4 (0.47) | SLC6A4SLC6A3SLC6A2CHRM2ADRA2A | |
| SCHEMBL9863766 | 0.74 | SLC6A3 (0.58) | SLC6A4SLC6A3SLC6A2CHRM2ADRA2A | |
| SCHEMBL9863983 | 0.72 | SLC6A3 (0.57) | SLC6A4SLC6A3SLC6A2CHRM2ADRA2A | |
| Hydrochloric Acid SCHEMBL9864297 | 0.72 | CYP3A4 (0.59) | SLC6A4SLC6A3SLC6A2CHRM2ADRA2A | |
| Hydrochloric Acid SCHEMBL7162515 | 0.72 | CYP3A4 (0.75) | SLC6A4SLC6A3SLC6A2CHRM2ADRA2A | |
| Hydrochloric Acid SCHEMBL9864690 | 0.71 | CYP3A4 (0.58) | SLC6A4SLC6A3SLC6A2CHRM2ADRA2A | |
| SCHEMBL9864248 | 0.71 | SLC6A4 (0.47) | SLC6A4SLC6A3SLC6A2CHRM2ADRA2A |
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 |
|---|---|---|---|---|---|---|---|
| US-5047432-A | Antidepressants | THE BOOTS COMPANY PLC (GB) | 1991-09-10 | — | — | US | disclosed |
| US-4925879-A | ANTIDEPRESSANTS | BOOTS COMPANY, PLC (GB) | 1990-05-15 | — | — | US | disclosed |
| EP-0191542-B1 | ARYLCYCLOBUTYLALKYL AMINES AND THEIR USE AS ANTIDEPRESSIVE MEDICINES | The Boots Company PLC (GB) | 1988-06-08 | — | — | EP | disclosed |
| EP-0191542-A1 | Arylcyclobutylalkyl amines and their use as antidepressive medicines | The Boots Company PLC (GB) | 1986-08-20 | — | — | EP | disclosed |