Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 2/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 11/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 10/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 6/20 | 0.44 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.42 |
| ▸ | CACNA1F | O60840 | 2/20 | 0.42 |
| ▸ | CACNA1D | Q01668 | 2/20 | 0.42 |
| ▸ | CACNA1S | Q13698 | 2/20 | 0.42 |
| ▸ | CACNA1C | Q13936 | 2/20 | 0.42 |
| ▸ | HTR7 | P34969 | 2/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | HTR6 | P50406 | 1/20 | 0.42 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11539874 | 0.87 | TSHR (0.44) | HTR2CSLC6A2SLC6A4SLC6A3HTR1A | |
| SCHEMBL11538270 | 0.85 | TSHR (0.47) | SLC6A2SLC6A4SLC6A3CYP2D6CYP1A2 | |
| SCHEMBL11543771 | 0.84 | MC4R (0.49) | HTR2CSLC6A2SLC6A4SLC6A3HTR1A | |
| SCHEMBL11813304 | 0.79 | HTR7 (0.47) | SLC6A2SLC6A4SLC6A3HTR1ACYP2D6 | |
| Hydrochloric Acid SCHEMBL6554472 | 0.74 | NPC1 (0.45) | SLC6A2SLC6A4SLC6A3HTR1ACYP2D6 | |
| SCHEMBL995182 | 0.73 | L3MBTL1 (0.43) | SLC6A2SLC6A4SLC6A3HTR1ACYP2D6 | |
| SCHEMBL10572425 | 0.71 | HTR1A (0.43) | SLC6A2SLC6A4SLC6A3HTR1ACYP2D6 | |
| SCHEMBL9674664 | 0.70 | ALDH1A1 (0.42) | SLC6A2SLC6A4SLC6A3CYP1A2CYP2C9 | |
| SCHEMBL29257051 | 0.69 | HTR2C (0.44) | HTR2CSLC6A2HTR1ACYP2D6CYP1A2 | |
| SCHEMBL10979801 | 0.69 | SLC6A4 (0.56) | SLC6A2SLC6A4SLC6A3CYP2D6KCNH2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4170653-A | Antidepressant naphthyloxy piperidino and pyrrolidino propanol ethers | Ayerst McKenna and Harrison Limited (CA) | 1979-10-09 | — | — | US | disclosed |
| US-4060613-A | ANTIDEPRESSANT | AYERST MCKENNA AND HARRISON LTD. (CA) | 1977-11-29 | — | — | US | disclosed |