Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
| ▸ | KCNJ5 | P48544 | 1/20 | 0.33 |
| ▸ | KCNJ3 | P48549 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | BRS3 | P32247 | 1/20 | 0.32 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.31 |
| ▸ | ALOX5AP | P20292 | 3/20 | 0.31 |
| ▸ | FBP1 | P09467 | 1/20 | 0.31 |
| ▸ | PDE4A | P27815 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3624702 | 0.78 | ADORA2A (0.44) | CYP1A2CYP2D6CYP2C9CYP2C19ADORA2A | |
| SCHEMBL13140080 | 0.74 | CYP1A2 (0.32) | CYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL3626099 | 0.74 | — | — | |
| SCHEMBL3620056 | 0.74 | CYP17A1 (0.37) | CYP1A2CYP2D6CYP2C9CYP2C19ADORA2A | |
| SCHEMBL3628999 | 0.74 | KDM4E (0.37) | CYP1A2CYP2D6CYP2C9CYP2C19ADORA2A | |
| SCHEMBL3626938 | 0.74 | KDM4E (0.37) | CYP1A2CYP2D6CYP2C9CYP2C19ADORA2A | |
| SCHEMBL13140313 | 0.73 | ADORA2A (0.41) | CYP1A2CYP2D6CYP2C9CYP2C19ADORA2A | |
| SCHEMBL3622108 | 0.73 | CYP1A2 (0.36) | CYP1A2CYP2D6CYP2C9CYP2C19ADORA2A | |
| SCHEMBL3618776 | 0.73 | CYP1A2 (0.42) | CYP1A2CYP2D6CYP2C9CYP2C19ADORA2A | |
| SCHEMBL3626670 | 0.73 | CYP1A2 (0.39) | CYP1A2CYP2D6CYP2C9CYP2C19ADORA2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010119878-A1 | PYRIMIDINE COMPOUND AND ITS USE FOR PEST CONTROL | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2010-10-21 | — | — | WO | disclosed |
| WO-2010119878-A1 | PYRIMIDINE COMPOUND AND ITS USE FOR PEST CONTROL | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2010-10-21 | — | — | WO | disclosed |