Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 4/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.54 |
| ▸ | LMNA | P02545 | 5/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.42 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.42 |
| ▸ | HTR2A | P28223 | 2/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.42 |
| ▸ | DRD2 | P14416 | 1/20 | 0.42 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.42 |
| ▸ | CNR1 | P21554 | 1/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.42 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | EBP | Q15125 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8085822 | 0.83 | CYP2D6 (0.51) | CYP2D6CYP1A2CYP2C19LMNASLC6A2 | |
| SCHEMBL5362452 | 0.82 | CYP2D6 (0.67) | CYP2D6CYP1A2CYP2C19LMNASLC6A2 | |
| SCHEMBL29336556 | 0.81 | CYP2D6 (0.61) | CYP2D6CYP1A2CYP2C19LMNASLC6A2 | |
| SCHEMBL31612483 | 0.80 | CYP2D6 (0.59) | CYP2D6CYP1A2CYP2C19LMNASLC6A2 | |
| SCHEMBL29336388 | 0.78 | CYP1A2 (0.56) | CYP2D6CYP1A2CYP2C19LMNASLC6A2 | |
| SCHEMBL7587851 | 0.77 | CYP2D6 (0.59) | CYP2D6CYP1A2CYP2C19LMNASLC6A2 | |
| SCHEMBL25761285 | 0.77 | CYP2D6 (0.59) | CYP2D6CYP1A2CYP2C19LMNASLC6A2 | |
| Hydrochloric Acid SCHEMBL28414863 | 0.77 | CYP2D6 (0.66) | CYP2D6CYP1A2CYP2C19LMNASLC6A2 | |
| Sulfuric Acid SCHEMBL11743989 | 0.75 | CYP1A2 (0.40) | CYP2D6CYP1A2CYP2C19LMNAHTT | |
| SCHEMBL4600393 | 0.74 | NR1H2 (0.50) | CYP2C19LMNASLC6A2HTR2ASLC6A4 |
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-5776652-A | Aromatic hexafluoropropanesulfonate diazonium salts and their use in radiation-sensitive mixtures | AGFA-GEVAERT AG (DE) | 1998-07-07 | — | — | US | disclosed |