Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 12/20 | 0.62 |
| ▸ | SLC6A4 | P31645 | 11/20 | 0.62 |
| ▸ | SLC6A2 | P23975 | 6/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL27734519 | 0.83 | SLC6A3 (0.60) | SLC6A3SLC6A4SLC6A2 | |
| SCHEMBL8284914 | 0.83 | SLC6A3 (0.56) | SLC6A3SLC6A4SLC6A2 | |
| SCHEMBL7262204 | 0.81 | SLC6A3 (0.53) | SLC6A3SLC6A4SLC6A2 | |
| SCHEMBL16410910 | 0.80 | SLC6A4 (0.60) | SLC6A3SLC6A4SLC6A2 | |
| SCHEMBL7262192 | 0.78 | SLC6A4 (0.58) | SLC6A3SLC6A4SLC6A2 | |
| SCHEMBL3520252 | 0.77 | SLC6A4 (1.00) | SLC6A3SLC6A4SLC6A2 | |
| SCHEMBL14618821 | 0.77 | SLC6A3 (0.49) | SLC6A3SLC6A4SLC6A2 | |
| Hydrochloric Acid SCHEMBL28148631 | 0.77 | SLC6A3 (0.58) | SLC6A3SLC6A4SLC6A2 | |
| SCHEMBL27734550 | 0.74 | SLC6A3 (0.62) | SLC6A3SLC6A4SLC6A2 | |
| SCHEMBL27754805 | 0.74 | SLC6A3 (0.62) | SLC6A3SLC6A4SLC6A2 |
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-A | Cycloalkylamines as monoamine reuptake inhibitors | SEPRACOR INC (US) | 2009-03-25 | — | — | CN | disclosed |