Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 15/20 | 0.55 |
| ▸ | SLC6A2 | P23975 | 14/20 | 0.55 |
| ▸ | SLC6A3 | Q01959 | 13/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.33 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.33 |
| ▸ | HRH2 | P25021 | 2/20 | 0.33 |
| ▸ | HTR2A | P28223 | 2/20 | 0.33 |
| ▸ | HRH1 | P35367 | 2/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | THPO | P40225 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL402344 | 0.74 | SLC6A4 (0.72) | SLC6A4SLC6A2SLC6A3CYP2D6POLB | |
| SCHEMBL402709 | 0.72 | SLC6A4 (0.70) | SLC6A4SLC6A2SLC6A3CYP2D6POLB | |
| SCHEMBL14775283 | 0.71 | SLC6A2 (1.00) | SLC6A4SLC6A2SLC6A3HRH3SIGMAR1 | |
| SCHEMBL403744 | 0.71 | SLC6A2 (0.64) | SLC6A4SLC6A2SLC6A3CYP2D6POLB | |
| SCHEMBL14775083 | 0.71 | SLC6A4 (1.00) | SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL14775500 | 0.70 | SLC6A2 (1.00) | SLC6A4SLC6A2SLC6A3CYP2D6CYP3A4 | |
| SCHEMBL404888 | 0.70 | SLC6A4 (1.00) | SLC6A4SLC6A2SLC6A3CYP2D6POLB | |
| SCHEMBL402755 | 0.70 | SLC6A2 (0.57) | SLC6A4SLC6A2SLC6A3CYP3A4 | |
| SCHEMBL406121 | 0.69 | SLC6A2 (0.55) | SLC6A4SLC6A2SLC6A3CYP2D6POLB | |
| SCHEMBL14775025 | 0.68 | SLC6A4 (1.00) | SLC6A4SLC6A2SLC6A3HRH3SIGMAR1 |
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-2285787-B1 | 3-SUBSTITUTED PROPANAMINE COMPOUNDS | SK BIOPHARMACEUTICALS CO LTD (KR) | 2015-08-26 | — | — | EP | disclosed |