Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.48 |
| ▸ | DRD2 | P14416 | 3/20 | 0.48 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.48 |
| ▸ | ADRA2C | P18825 | 3/20 | 0.48 |
| ▸ | HTR2A | P28223 | 3/20 | 0.48 |
| ▸ | HTR2C | P28335 | 3/20 | 0.48 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.48 |
| ▸ | HRH1 | P35367 | 3/20 | 0.48 |
| ▸ | DRD3 | P35462 | 3/20 | 0.48 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.48 |
| ▸ | HTR2B | P41595 | 3/20 | 0.48 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.48 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.48 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.48 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL7813062 | 0.89 | ALDH1A1 (0.45) | SIGMAR1CYP2D6ALDH1A1ADRA2ADRD2 | |
| SCHEMBL6968455 | 0.87 | SIGMAR1 (0.53) | SIGMAR1CYP2D6ALDH1A1ADRA2ADRD2 | |
| Hydrochloric Acid SCHEMBL6971970 | 0.86 | LMNA (0.52) | SIGMAR1CYP2D6ALDH1A1ADRA2ADRD2 | |
| SCHEMBL7609508 | 0.83 | SIGMAR1 (0.49) | SIGMAR1CYP2D6ALDH1A1ADRA2ADRD2 | |
| SCHEMBL7611480 | 0.82 | SIGMAR1 (0.47) | SIGMAR1CYP2D6ALDH1A1ADRA2ADRD2 | |
| SCHEMBL6955699 | 0.82 | SIGMAR1 (0.50) | SIGMAR1CYP2D6ALDH1A1ADRA2ADRD2 | |
| SCHEMBL7603762 | 0.81 | SIGMAR1 (0.47) | SIGMAR1CYP2D6ALDH1A1ADRA2ADRD2 | |
| SCHEMBL7604131 | 0.80 | CYP2D6 (0.46) | SIGMAR1CYP2D6ALDH1A1ADRA2ADRD2 | |
| SCHEMBL6954799 | 0.79 | HRH1 (0.44) | SIGMAR1DRD2HTR2AHTR2CHRH1 | |
| SCHEMBL7816017 | 0.79 | SLC6A1 (0.53) | CYP2D6ALDH1A1LMNACYP1A2CYP2C19 |
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-0934313-B1 | N-SUBSTITUTED AZAHETEROCYCLIC COMPOUNDS | NOVO NORDISK AS (DK) | 2003-05-14 | — | — | EP | claimed |