Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.53 |
| ▸ | HTR2A | P28223 | 6/20 | 0.51 |
| ▸ | HRH1 | P35367 | 5/20 | 0.51 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 7/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 7/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 4/20 | 0.41 |
| ▸ | SCN1A | P35498 | 3/20 | 0.41 |
| ▸ | SCN2A | Q99250 | 3/20 | 0.41 |
| ▸ | SCN3A | Q9NY46 | 3/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 6/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.40 |
| ▸ | CHRM5 | P08912 | 3/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.40 |
| ▸ | HRH2 | P25021 | 3/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.40 |
| ▸ | HTR2C | P28335 | 3/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9857086 | 0.83 | HTR2A (0.53) | HTR2AHRH1SLC6A2SLC6A4CHRM2 | |
| SCHEMBL9856891 | 0.83 | HTR2A (0.53) | HTR2AHRH1SLC6A2SLC6A4CHRM2 | |
| SCHEMBL9857061 | 0.82 | SLC6A4 (0.42) | TAAR1HTR2AHRH1SLC6A2SLC6A4 | |
| SCHEMBL9856826 | 0.81 | TAAR1 (0.53) | TAAR1HTR2AHRH1SLC6A2SLC6A4 | |
| SCHEMBL9856513 | 0.81 | TAAR1 (0.53) | TAAR1HTR2AHRH1AOC3SLC6A2 | |
| SCHEMBL9857042 | 0.80 | SLC6A4 (0.48) | HTR2AHRH1SLC6A2SLC6A4KCNH2 | |
| SCHEMBL9857006 | 0.80 | HTR2A (0.50) | TAAR1HTR2AHRH1SLC6A2SLC6A4 | |
| SCHEMBL9856862 | 0.79 | HTR2A (0.49) | HTR2AHRH1AOC3SLC6A2SLC6A4 | |
| SCHEMBL9857222 | 0.79 | HTR2A (0.49) | HTR2AHRH1SLC6A2SLC6A4CHRM2 | |
| SCHEMBL11582047 | 0.79 | HTR2A (0.45) | HTR2AHRH1CHRM1TSHRCYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-4996235-A | Selectively inhibiting the uptake of serotonin and norepinephrine | ELI LILLY AND COMPANY (US) | 1991-02-26 | — | — | US | disclosed |