Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 3/20 | 0.43 |
| ▸ | HRH1 | P35367 | 3/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 6/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.40 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.36 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9856543 | 0.81 | SLC6A4 (0.40) | HTR2AHRH1TAAR1SLC6A4SLC6A2 | |
| SCHEMBL19688012 | 0.78 | TRPA1 (0.42) | TAAR1SLC6A4SIGMAR1SLC18A2SLC6A2 | |
| SCHEMBL8384207 | 0.78 | HTR2A (0.60) | HTR2AHRH1TAAR1ATMSLC6A4 | |
| SCHEMBL9856421 | 0.73 | HTR2A (0.44) | HTR2AHRH1TAAR1ATMSLC6A4 | |
| SCHEMBL10446796 | 0.73 | HTR2A (0.52) | HTR2AHRH1TAAR1ATMSLC6A4 | |
| SCHEMBL2072466 | 0.73 | CYP2D6 (0.65) | HTR2ASLC6A4SLC6A2KCNH2CYP3A4 | |
| SCHEMBL9857056 | 0.72 | HTR2A (0.51) | HTR2AHRH1TAAR1SLC6A4SLC6A2 | |
| Sulfuric Acid SCHEMBL9856834 | 0.72 | ALOX15 (0.42) | SLC6A4SLC6A2CYP3A4CYP2D6L3MBTL1 | |
| SCHEMBL9856768 | 0.72 | TAAR1 (0.54) | HTR2AHRH1TAAR1ATMSLC6A4 | |
| SCHEMBL9856698 | 0.71 | TAAR1 (0.42) | HTR2AHRH1TAAR1SLC6A4SLC6A2 |
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-4996235-A | Selectively inhibiting the uptake of serotonin and norepinephrine | ELI LILLY AND COMPANY (US) | 1991-02-26 | — | — | US | disclosed |
| EP-0318233-A2 | Improvements in or relating to serotonin and norepinephrine uptake inhibitors | ELI LILLY AND COMPANY (US) | 1989-05-31 | — | — | EP | disclosed |