Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.39 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.37 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.37 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.37 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Cyanide SCHEMBL30330259 | 0.94 | CYP1A2 (0.58) | CYP1A2ALDH1A1ADRA2AS1PR1S1PR3 | |
| SCHEMBL60463 | 0.94 | — | — | |
| SCHEMBL11926 | 0.94 | — | — | |
| SCHEMBL11921 | 0.94 | — | — | |
| Iodide SCHEMBL29010172 | 0.91 | CYP1A2 (0.53) | CYP1A2ALDH1A1ADRA2AS1PR4S1PR1 | |
| Bromide SCHEMBL27865865 | 0.91 | CYP1A2 (0.53) | CYP1A2ALDH1A1ADRA2AS1PR4S1PR1 | |
| SCHEMBL3476022 | 0.87 | CYP1A2 (0.64) | CYP1A2ALDH1A1ADRA2AS1PR1S1PR3 | |
| SCHEMBL1760663 | 0.87 | CYP1A2 (0.64) | CYP1A2ALDH1A1ADRA2AS1PR1S1PR3 | |
| SCHEMBL28122639 | 0.86 | CYP1A2 (0.48) | CYP1A2ALDH1A1ADRA2A | |
| Fluoride SCHEMBL30212759 | 0.85 | CYP1A2 (0.62) | CYP1A2ALDH1A1ADRA2AS1PR1S1PR3 |
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-2023046704-A1 | ELECTROCHEMICAL GAS SENSOR AND ELECTROLYTE FOR AN ELECTROCHEMICAL GAS SENSOR | Dräger Safety AG & Co. KGaA (DE) | 2023-03-30 | — | — | WO | disclosed |