Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 7/20 | 0.67 |
| ▸ | HTR2A | P28223 | 7/20 | 0.67 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.47 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.46 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.44 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.41 |
| ▸ | HTR1B | P28222 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.40 |
| ▸ | DRD1 | P21728 | 1/20 | 0.40 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 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 | |
|---|---|---|---|---|
| Butylamine SCHEMBL9108656 | 0.90 | HRH1 (0.55) | HRH1HTR2ASIGMAR1AOC3SLC7A5 | |
| SCHEMBL107889 | 0.85 | HRH1 (0.56) | HRH1HTR2ASIGMAR1TAAR1AOC3 | |
| Butylamine SCHEMBL6014457 | 0.85 | TAAR1 (0.53) | HRH1HTR2ATAAR1AOC3SLC7A5 | |
| Hydrochloric Acid SCHEMBL6521685 | 0.83 | HRH1 (0.54) | HRH1HTR2ASIGMAR1TAAR1AOC3 | |
| Hydrogen Peroxide SCHEMBL27864054 | 0.83 | HRH1 (0.54) | HRH1HTR2ASIGMAR1TAAR1AOC3 | |
| SCHEMBL28229621 | 0.83 | HRH1 (0.54) | HRH1HTR2ASIGMAR1TAAR1AOC3 | |
| Ammonia Solution, Strong SCHEMBL5724927 | 0.83 | HRH1 (0.54) | HRH1HTR2ASIGMAR1TAAR1AOC3 | |
| Butylamine SCHEMBL6014499 | 0.81 | TAAR1 (0.53) | HRH1HTR2ATAAR1AOC3SLC7A5 | |
| SCHEMBL157808 | 0.81 | HRH1 (1.00) | HRH1HTR2ASIGMAR1TAAR1HTR1B | |
| SCHEMBL1293020 | 0.81 | SIGMAR1 (0.61) | HRH1HTR2ASIGMAR1CHRM2HTR1A |
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 |
|---|---|---|---|---|---|---|---|
| WO-1995010270-A1 | METHOD FOR TREATING URINARY INCONTINENCE USING OPTICALLY PURE S-TERODILINE | SEPRACOR, INC. (US) | 1995-04-20 | — | — | WO | disclosed |