Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR8 | P51685 | 6/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 6/20 | 0.36 |
| ▸ | NAMPT | P43490 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.33 |
| ▸ | HTR1A | P08908 | 2/20 | 0.33 |
| ▸ | DRD2 | P14416 | 2/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.33 |
| ▸ | USP2 | O75604 | 2/20 | 0.33 |
| ▸ | NSD2 | O96028 | 2/20 | 0.33 |
| ▸ | ACACA | Q13085 | 1/20 | 0.33 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL22908539 | 0.89 | CCR8 (0.47) | CCR8KCNH2CYP3A4CYP2D6DRD2 | |
| SCHEMBL22908445 | 0.89 | CYP3A4 (0.34) | CCR8KCNH2CYP3A4CYP2D6HTR1A | |
| SCHEMBL22908439 | 0.87 | HTR1A (0.38) | CCR8KCNH2HTR1AACACA | |
| SCHEMBL22908552 | 0.86 | CYP3A4 (0.44) | CCR8KCNH2CYP3A4CYP2D6USP2 | |
| SCHEMBL22992042 | 0.86 | NAMPT (0.37) | CCR8KCNH2NAMPTCYP3A4CYP2D6 | |
| SCHEMBL22908553 | 0.85 | TDP1 (0.43) | CCR8KCNH2CYP3A4CYP2D6 | |
| SCHEMBL22908440 | 0.85 | HTR1A (0.37) | CCR8KCNH2CYP3A4CYP2D6HTR1A | |
| SCHEMBL22908538 | 0.85 | CCR8 (0.41) | CCR8KCNH2CYP3A4CYP2D6HTR1A | |
| SCHEMBL22908432 | 0.85 | ACACA (0.33) | CCR8KCNH2ACACA | |
| SCHEMBL22908441 | 0.84 | DRD3 (0.41) | CCR8KCNH2HTR1AADRA1A |
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 |