Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EDNRB | P24530 | 11/20 | 0.46 |
| ▸ | EDNRA | P25101 | 11/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | NFE2L2 | Q16236 | 3/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | AHR | P35869 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9411998 | 1.00 | EDNRB (0.46) | EDNRBEDNRACYP1A2CYP2C9CYP2C19 | |
| SCHEMBL9412740 | 0.73 | EDNRB (0.43) | EDNRBEDNRAL3MBTL1 | |
| SCHEMBL9295985 | 0.64 | EDNRB (0.40) | EDNRBEDNRAL3MBTL1 | |
| SCHEMBL9367368 | 0.64 | EDNRB (0.38) | EDNRBEDNRAL3MBTL1 | |
| SCHEMBL9367373 | 0.64 | EDNRB (0.38) | EDNRBEDNRAL3MBTL1 | |
| SCHEMBL30953547 | 0.64 | AHR (0.43) | CYP1A2CYP2C19NPSR1NFE2L2ALDH1A1 | |
| SCHEMBL14465008 | 0.63 | AHR (0.48) | CYP1A2NFE2L2AHR | |
| SCHEMBL9967711 | 0.63 | AHR (0.48) | CYP1A2NFE2L2AHR | |
| SCHEMBL10131184 | 0.63 | AHR (0.48) | CYP1A2NFE2L2AHR | |
| SCHEMBL9412032 | 0.63 | MAOA (0.51) | CYP1A2CYP2C9CYP2C19ALDH1A1AHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-0611759-A1 | Pyrimidinyloxy/triazinyloxy alkanol derivatives and their use as herbicides | NIHON BAYER AGROCHEM K.K. (JP) | 1994-08-24 | — | — | EP | disclosed |