Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 20/20 | 0.64 |
| ▸ | SLC6A3 | Q01959 | 20/20 | 0.64 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.41 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL28845096 | 0.85 | SLC6A4 (0.65) | SLC6A4SLC6A3SLC6A2KCNH2 | |
| SCHEMBL28149795 | 0.79 | SLC6A4 (0.58) | SLC6A4SLC6A3SLC6A2CYP2D6KCNH2 | |
| SCHEMBL17999746 | 0.78 | SLC6A4 (1.00) | SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL17999745 | 0.78 | SLC6A4 (1.00) | SLC6A4SLC6A3SLC6A2 | |
| Hydrochloric Acid SCHEMBL11118205 | 0.78 | SLC6A4 (0.57) | SLC6A4SLC6A3SLC6A2CYP2D6KCNH2 | |
| SCHEMBL28149780 | 0.78 | SLC6A4 (0.59) | SLC6A4SLC6A3SLC6A2CYP2D6KCNH2 | |
| Hydrochloric Acid SCHEMBL3517561 | 0.76 | KCNH2 (0.59) | SLC6A4SLC6A3SLC6A2CYP2D6KCNH2 | |
| SCHEMBL8240961 | 0.75 | SLC6A3 (0.74) | SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL8239538 | 0.75 | SLC6A3 (1.00) | SLC6A4SLC6A3SLC6A2CYP2D6CYP2C19 | |
| SCHEMBL13253864 | 0.75 | SLC6A3 (1.00) | SLC6A4SLC6A3SLC6A2CYP2D6CYP2C19 |
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-101394847-B | Cycloalkylamines as monoamine reuptake inhibitors | 塞普拉柯公司 | 2017-05-24 | — | — | CN | claimed |