Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9195994 | 0.88 | ALDH1A1 (0.57) | CYP1A2CYP2C9CYP2C19CYP3A4GAA | |
| SCHEMBL9156889 | 0.85 | CYP1A2 (0.42) | CYP1A2CYP2C9CYP2C19CYP3A4GAA | |
| SCHEMBL9294647 | 0.84 | ALDH1A1 (0.56) | CYP1A2CYP2C9CYP2C19CYP3A4GAA | |
| SCHEMBL8659409 | 0.82 | NPSR1 (0.39) | CYP1A2CYP2C9CYP2C19CYP3A4GAA | |
| SCHEMBL9293375 | 0.80 | CYP1A2 (0.49) | CYP1A2CYP2C9CYP2C19CYP3A4GAA | |
| SCHEMBL9294680 | 0.80 | CA12 (0.56) | CYP1A2CYP2C9CYP2C19CYP3A4GAA | |
| SCHEMBL9197640 | 0.80 | CYP1A2 (0.47) | CYP1A2CYP2C9CYP2C19CYP3A4GAA | |
| SCHEMBL7754495 | 0.80 | CYP1A2 (0.47) | CYP1A2CYP2C9CYP2C19CYP3A4GAA | |
| SCHEMBL8660857 | 0.79 | TXNRD1 (0.38) | NPSR1ALDH1A1 | |
| SCHEMBL9198260 | 0.79 | CYP1A2 (0.44) | CYP1A2CYP2C9CYP2C19CYP3A4GAA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0321846-B1 | Pyrimidine derivatives, processes for their production, and herbicidal method and compositions | KUMIAI CHEMICAL INDUSTRY CO (JP) | 1995-04-19 | — | — | EP | disclosed |
| US-5081244-A | PYRIMIDINE DERIVATIVES, PROCESSES FOR THEIR PRODUCTION, AND HERBICIDAL METHOD AND COMPOSITIONS | KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) | 1992-01-14 | — | — | US | disclosed |
| US-4906285-A | Pyrimidine derivatives and herbicidal method and compositions | KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) | 1990-03-06 | — | — | US | disclosed |
| EP-0321846-A2 | Pyrimidine derivatives, processes for their production, and herbicidal method and compositions | KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) | 1989-06-28 | — | — | EP | disclosed |