Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | HRH1 | P35367 | 1/20 | 0.40 |
| ▸ | HTR2B | P41595 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.36 |
| ▸ | MME | P08473 | 2/20 | 0.36 |
| ▸ | ACE | P12821 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 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 | |
|---|---|---|---|---|
| SCHEMBL14169913 | 0.80 | ADRA2A (0.46) | ADRA2AADRA2BADRA2CSLC6A2HTR2A | |
| SCHEMBL14169906 | 0.79 | RAB9A (0.45) | ADRA2AADRA2BADRA2CSLC6A2HTR2A | |
| SCHEMBL14169922 | 0.76 | RAB9A (0.41) | ADRA2AADRA2BADRA2CSLC6A2HTR2A | |
| SCHEMBL14169908 | 0.76 | ACE (0.43) | ADRA2AADRA2BADRA2CSLC6A2HTR2A | |
| SCHEMBL14169919 | 0.74 | ALDH1A1 (0.39) | ADRA2AADRA2BADRA2CSLC6A2HTR2A | |
| SCHEMBL14169899 | 0.72 | FNTA (0.50) | KCNH2MMEACETSHRADORA2A | |
| SCHEMBL21339127 | 0.70 | ADRA2A (0.67) | ADRA2AADRA2BADRA2CSLC6A2HTR2A | |
| SCHEMBL12894137 | 0.70 | ANPEP (0.53) | ADRA2AADRA2BADRA2CSLC6A2HTR2A | |
| SCHEMBL14170136 | 0.67 | ADRA2A (0.50) | ADRA2AADRA2BADRA2CSLC6A2HTR2A | |
| SCHEMBL14193205 | 0.67 | SLC6A2 (0.50) | ADRA2AADRA2BADRA2CSLC6A2HTR2A |
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-2019170919-A1 | HYBRID MU OPIOID RECEPTOR AND NEUROPEPTIDE FF RECEPTOR BINDING MOLECULES, THEIR METHODS OF PREPARATION AND APPLICATIONS IN THERAPEUTIC TREATMENT | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) | 2019-09-12 | — | — | WO | disclosed |