Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 18/20 | 0.78 |
| ▸ | SLC6A2 | P23975 | 15/20 | 0.78 |
| ▸ | SLC6A4 | P31645 | 10/20 | 0.78 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.54 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.54 |
| ▸ | DRD3 | P35462 | 1/20 | 0.54 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.54 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL15162038 | 1.00 | SLC6A3 (0.78) | SLC6A3SLC6A2SLC6A4CHRM2ADRA2B | |
| Hydrochloric Acid SCHEMBL15162052 | 0.98 | SLC6A3 (0.76) | SLC6A3SLC6A2SLC6A4 | |
| Pyrovalerone SCHEMBL4930605 | 0.88 | SLC6A3 (1.00) | SLC6A3SLC6A2SLC6A4 | |
| Pyrovalerone SCHEMBL4929129 | 0.88 | SLC6A3 (1.00) | SLC6A3SLC6A2SLC6A4 | |
| Pyrovalerone SCHEMBL164376 | 0.88 | SLC6A3 (1.00) | SLC6A3SLC6A2SLC6A4 | |
| Pyrovalerone SCHEMBL121638 | 0.86 | SLC6A3 (0.97) | SLC6A3SLC6A2SLC6A4 | |
| SCHEMBL4730574 | 0.86 | SLC6A3 (0.59) | SLC6A3SLC6A2SLC6A4 | |
| SCHEMBL4939421 | 0.85 | SLC6A3 (0.77) | SLC6A3SLC6A2SLC6A4 | |
| Pyrovalerone SCHEMBL1649739 | 0.85 | SLC6A3 (0.94) | SLC6A3SLC6A2SLC6A4 | |
| SCHEMBL17043263 | 0.85 | SLC6A3 (0.84) | SLC6A3SLC6A2SLC6A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2626358-B1 | Immunoassay for pyrrolidinophenones | RANDOX LAB LTD (GB) | 2015-09-02 | — | — | EP | claimed |