Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 6/20 | 0.54 |
| ▸ | HTR2C | P28335 | 6/20 | 0.54 |
| ▸ | HRH1 | P35367 | 4/20 | 0.54 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.54 |
| ▸ | DRD2 | P14416 | 3/20 | 0.54 |
| ▸ | ADRA2C | P18825 | 3/20 | 0.54 |
| ▸ | DRD1 | P21728 | 3/20 | 0.54 |
| ▸ | DRD3 | P35462 | 3/20 | 0.54 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.54 |
| ▸ | HTR1A | P08908 | 1/20 | 0.54 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.54 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.54 |
| ▸ | DRD4 | P21917 | 1/20 | 0.54 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.54 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.54 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.54 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.54 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.54 |
| ▸ | HTR2B | P41595 | 1/20 | 0.54 |
| ▸ | HTR3A | P46098 | 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 | |
|---|---|---|---|---|
| SCHEMBL19256731 | 0.91 | HTR2A (0.57) | HTR2AHTR2CHRH1ADRA2ADRD2 | |
| SCHEMBL19256087 | 0.90 | HTR2A (0.53) | HTR2AHTR2CHRH1ADRA2ADRD2 | |
| SCHEMBL19256564 | 0.89 | HTR2A (0.59) | HTR2AHTR2CHRH1ADRA2ADRD2 | |
| SCHEMBL19256085 | 0.87 | HTR2A (0.50) | HTR2AHTR2CHRH1ADRA2ADRD2 | |
| SCHEMBL19256447 | 0.85 | HTR2A (0.55) | HTR2AHTR2CHRH1ADRA2ADRD2 | |
| SCHEMBL19256729 | 0.82 | HTR2A (0.56) | HTR2AHTR2CHRH1ADRA2ADRD2 | |
| SCHEMBL19255991 | 0.81 | HTR2A (0.57) | HTR2AHTR2CHRH1ADRA2ADRD2 | |
| SCHEMBL19255988 | 0.81 | HTR2A (0.61) | HTR2AHTR2CHRH1ADRA2ADRD2 | |
| SCHEMBL12413559 | 0.80 | HRH2 (0.46) | HTR2AHTR2CHRH1ADRA2ADRD2 | |
| SCHEMBL12413554 | 0.80 | HRH2 (0.47) | HTR2AHTR2CHRH1ADRA2ADRD2 |
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-2521711-B1 | QUATERNARY AMMONIUM SALT PRODRUGS | ALKERMES PHARMA IRELAND LTD (IE) | 2017-08-16 | — | — | EP | disclosed |