Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | RAD52 | P43351 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
| ▸ | DRD3 | P35462 | 2/20 | 0.33 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.33 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.33 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | CACNA1S | Q13698 | 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 | |
|---|---|---|---|---|
| SCHEMBL11841079 | 0.95 | AOC3 (0.36) | AOC3CYP1A2CYP2D6RAD52SLC6A2 | |
| SCHEMBL11731938 | 0.93 | CACNA1F (0.39) | AOC3CYP1A2CYP2D6RAD52SLC6A2 | |
| Hydrochloric Acid SCHEMBL11727411 | 0.92 | CACNA1F (0.39) | AOC3CYP1A2CYP2D6RAD52ABCC4 | |
| SCHEMBL11726513 | 0.88 | AOC3 (0.38) | AOC3ABCC4PTGS1DRD3ADRB2 | |
| SCHEMBL11834556 | 0.86 | AOC3 (0.40) | AOC3SLC6A2SLC6A3ABCC4PTGS1 | |
| Hydrochloric Acid SCHEMBL11730608 | 0.81 | AOC3 (0.39) | AOC3ABCC4PTGS1ADRB2HTR2A | |
| SCHEMBL11842841 | 0.81 | AOC3 (0.39) | AOC3ABCC4PTGS1ADRB2HTR2A | |
| SCHEMBL11734266 | 0.80 | PTGS1 (0.37) | AOC3ABCC4PTGS1DRD3ADRB2 | |
| Hydrochloric Acid SCHEMBL11728247 | 0.80 | PTGS2 (0.35) | CYP1A2CYP2D6RAD52SLC6A2SLC6A3 | |
| SCHEMBL11779210 | 0.77 | CHRM2 (0.44) | CYP1A2CYP2D6RAD52SLC6A2SLC6A3 |
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-4008240-A | VIRICIDE | RICHARDSON-MERRELL INC. (US) | 1977-02-15 | — | — | US | disclosed |