Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.64 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.64 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | ATM | Q13315 | 1/20 | 0.50 |
| ▸ | CA12 | O43570 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | CA7 | P43166 | 1/20 | 0.50 |
| ▸ | CA9 | Q16790 | 1/20 | 0.50 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL8801724 | 0.99 | ALDH1A1 (0.63) | ALDH1A1SMN1; SMN2NPSR1CYP1A2CYP2C9 | |
| Bispyribac SCHEMBL4895772 | 0.91 | CA12 (0.56) | ALDH1A1SMN1; SMN2NPSR1CYP1A2CYP2C9 | |
| Bispyribac SCHEMBL65725 | 0.91 | CA12 (0.56) | ALDH1A1SMN1; SMN2NPSR1CYP1A2CYP2C9 | |
| SCHEMBL9873521 | 0.91 | ALDH1A1 (0.58) | ALDH1A1SMN1; SMN2NPSR1CYP1A2CYP2C9 | |
| Bispyribac SCHEMBL9195440 | 0.90 | CA12 (0.54) | ALDH1A1SMN1; SMN2NPSR1CYP1A2CYP2C9 | |
| Bispyribac SCHEMBL238471 | 0.90 | CA12 (0.54) | ALDH1A1SMN1; SMN2NPSR1CYP1A2CYP2C9 | |
| Bispyribac SCHEMBL2114791 | 0.90 | CA12 (0.54) | ALDH1A1SMN1; SMN2NPSR1CYP1A2CYP2C9 | |
| SCHEMBL8952122 | 0.89 | CA12 (0.62) | NPSR1CYP1A2CYP2C9CYP2C19CA12 | |
| SCHEMBL8939116 | 0.88 | NPSR1 (0.60) | ALDH1A1SMN1; SMN2NPSR1 | |
| SCHEMBL9539769 | 0.87 | LMNA (0.53) | NPSR1CYP1A2CYP2C9CYP2C19CA12 |
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 3 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-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 |