Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | LIPE | Q05469 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 3/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.38 |
| ▸ | DRD1 | P21728 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | HRH1 | P35367 | 1/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11697724 | 0.89 | ALDH1A1 (0.41) | CYP2D6CYP2C19LMNATAAR1GAA | |
| SCHEMBL11698787 | 0.84 | CYP2D6 (0.37) | CYP2D6CYP2C19LMNATAAR1GAA | |
| SCHEMBL3989090 | 0.83 | CYP2D6 (0.44) | CYP2D6CYP2C19LMNATAAR1LIPE | |
| SCHEMBL13338372 | 0.83 | CYP2D6 (0.47) | CYP2D6CYP2C19LMNATAAR1GAA | |
| SCHEMBL4500673 | 0.82 | CYP2D6 (0.47) | CYP2D6CYP2C19LMNATAAR1LIPE | |
| SCHEMBL21884184 | 0.80 | CYP2D6 (0.42) | CYP2D6CYP2C19TAAR1LIPEPOLB | |
| SCHEMBL14813491 | 0.78 | POLB (0.39) | CYP2D6CYP2C19LMNAGAAPOLB | |
| SCHEMBL28679009 | 0.77 | POLB (0.44) | LMNAGAALIPEPOLBNPC1 | |
| SCHEMBL13338416 | 0.76 | ALDH1A1 (0.46) | CYP2D6CYP2C19LMNATAAR1GAA | |
| SCHEMBL17070034 | 0.75 | CYP2D6 (0.48) | CYP2D6CYP2C19LMNATAAR1LIPE |
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-4063887-A | HYDROXYAMINE COMPOUND | CELANESE CORPORATION (US) | 1977-12-20 | — | — | US | disclosed |