Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7850805 | 0.91 | CYP1A2 (0.47) | CYP1A2CYP3A4CYP2C9CYP2C19GAA | |
| SCHEMBL8912673 | 0.84 | CYP1A2 (0.43) | CYP1A2CYP3A4CYP2C9CYP2C19GAA | |
| Bispyribac SCHEMBL65725 | 0.84 | CA12 (0.56) | CYP1A2CYP3A4CYP2C9CYP2C19GAA | |
| Bispyribac SCHEMBL4895772 | 0.84 | CA12 (0.56) | CYP1A2CYP3A4CYP2C9CYP2C19GAA | |
| SCHEMBL9215334 | 0.83 | CYP1A2 (0.52) | CYP1A2CYP3A4CYP2C9CYP2C19GAA | |
| SCHEMBL13197224 | 0.83 | CYP1A2 (0.51) | CYP1A2CYP3A4CYP2C9CYP2C19GAA | |
| Bispyribac SCHEMBL2114791 | 0.82 | CA12 (0.54) | CYP1A2CYP3A4CYP2C9CYP2C19GAA | |
| Bispyribac SCHEMBL238471 | 0.82 | CA12 (0.54) | CYP1A2CYP3A4CYP2C9CYP2C19GAA | |
| Bispyribac SCHEMBL9195440 | 0.82 | CA12 (0.54) | CYP1A2CYP3A4CYP2C9CYP2C19GAA | |
| SCHEMBL9754398 | 0.81 | CYP1A2 (0.51) | CYP1A2CYP3A4CYP2C9CYP2C19GAA |
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 |
|---|---|---|---|---|---|---|---|
| US-5627136-A | HERBICIDES, ANTIGROWTH REGULATORS AND PLANT GROWTH REGULATORS | BASF AKTIENGESELLSCHAFT (DE) | 1997-05-06 | — | — | US | disclosed |
| EP-0656357-A1 | Substituted pyridyl-n-oxide salicylic aldehyde and salicylic acid derivatives, methods for preparing them and their use as herbicides | BASF Aktiengesellschaft (DE) | 1995-06-07 | — | — | EP | disclosed |