Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.45 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.45 |
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.42 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.42 |
| ▸ | TAS1R2 | Q8TE23 | 2/20 | 0.42 |
| ▸ | WNT1 | P04628 | 2/20 | 0.40 |
| ▸ | GSK3B | P49841 | 2/20 | 0.40 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.40 |
| ▸ | CLK2 | P49760 | 1/20 | 0.40 |
| ▸ | CLK3 | P49761 | 1/20 | 0.40 |
| ▸ | BRAF | P15056 | 2/20 | 0.39 |
| ▸ | SUCNR1 | Q9BXA5 | 1/20 | 0.38 |
| ▸ | RAF1 | P04049 | 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 | |
|---|---|---|---|---|
| SCHEMBL433524 | 0.89 | RAF1 (0.43) | SLC6A3KCNH2TAAR1BRAFRAF1 | |
| SCHEMBL434762 | 0.88 | SLC6A3 (0.45) | SLC6A3KCNH2TAAR1TAS1R3TAS1R1 | |
| SCHEMBL431125 | 0.85 | SLC6A3 (0.45) | SLC6A3KCNH2TAAR1TAS1R3TAS1R1 | |
| SCHEMBL434455 | 0.85 | SLC6A3 (0.45) | SLC6A3KCNH2TAAR1TAS1R3TAS1R1 | |
| SCHEMBL432424 | 0.80 | PIK3CD (0.39) | TAS1R3TAS1R1TAS1R2 | |
| SCHEMBL432425 | 0.78 | HDAC2 (0.39) | TAS1R3TAS1R1TAS1R2GSK3BRAF1 | |
| SCHEMBL432745 | 0.76 | SCN9A (0.36) | GSK3B | |
| SCHEMBL432167 | 0.71 | TRPV1 (0.40) | TAS1R3TAS1R1TAS1R2BRAFRAF1 | |
| SCHEMBL461386 | 0.71 | SLC6A3 (0.34) | SLC6A3KCNH2TAAR1WNT1GSK3B | |
| SCHEMBL432002 | 0.69 | TAS1R3 (0.38) | TAS1R3TAS1R1TAS1R2GSK3B |
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-2012012366-A1 | PESTICIDAL 3-(ARYLOXY)AZACYCLOALKANES | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2012-01-26 | — | — | WO | disclosed |