Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | TRPC6 | Q9Y210 | 9/20 | 0.37 |
| ▸ | MAPK7 | Q13164 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 3/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.37 |
| ▸ | GPR183 | P32249 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.35 |
| ▸ | BTK | Q06187 | 1/20 | 0.35 |
| ▸ | CCR8 | P51685 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL22908557 | 0.89 | TRPC6 (0.40) | TRPC6MAPK7 | |
| SCHEMBL22908440 | 0.89 | HTR1A (0.37) | TRPC6HTR1AADRA1ACYP1A2CYP2C9 | |
| SCHEMBL22908444 | 0.89 | EPHX2 (0.36) | TRPC6CYP1A2CYP2C9CYP2C19CCR8 | |
| SCHEMBL21343892 | 0.88 | DRD3 (0.43) | DRD3TRPC6MAPK7GPR183CYP1A2 | |
| SCHEMBL22908539 | 0.88 | CCR8 (0.47) | ADRA1ACYP1A2CYP2C9CYP2C19CCR8 | |
| SCHEMBL22908431 | 0.88 | GRM3 (0.46) | HTR1AGPR183CYP1A2CYP2C9 | |
| SCHEMBL22908445 | 0.87 | CYP3A4 (0.34) | HTR1AADRA1ACYP1A2BTKCCR8 | |
| SCHEMBL22908432 | 0.85 | ACACA (0.33) | BTKCCR8KCNH2 | |
| SCHEMBL22908552 | 0.84 | CYP3A4 (0.44) | CYP1A2CYP2C9CYP2C19CCR8KCNH2 | |
| SCHEMBL22908437 | 0.84 | MGLL (0.44) | DRD3HTR1ACCR8KCNH2 |
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-2021009048-A1 | HERBICIDAL CYCLOHEXANEDIONE DERIVATIVES | SYNGENTA CROP PROTECTION AG (CH) | 2021-01-21 | — | — | WO | disclosed |