Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.48 |
| ▸ | ATM | Q13315 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.44 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.42 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.42 |
| ▸ | EDNRB | P24530 | 4/20 | 0.41 |
| ▸ | EDNRA | P25101 | 4/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8585374 | 0.80 | KDM4E (0.49) | CYP1A2CYP2C9CYP2C19CYP3A4NPSR1 | |
| SCHEMBL9467440 | 0.79 | CYP1A2 (0.46) | CYP1A2CYP2C9CYP2C19CYP3A4NPSR1 | |
| SCHEMBL8575646 | 0.75 | SLC6A3 (0.56) | GAAALDH1A1SMN1; SMN2SLC6A3SLC6A4 | |
| SCHEMBL9790236 | 0.74 | BCAT2 (0.61) | GAASMN1; SMN2SLC6A3SLC6A4HTT | |
| SCHEMBL9475471 | 0.72 | ALDH1A1 (0.59) | CYP1A2CYP2C9CYP2C19CYP3A4NPSR1 | |
| SCHEMBL27569605 | 0.72 | ALDH1A1 (0.56) | CYP1A2CYP2C9CYP2C19CYP3A4NPSR1 | |
| SCHEMBL1775832 | 0.71 | SLC6A3 (0.74) | ATMGAAALDH1A1SMN1; SMN2SLC6A3 | |
| SCHEMBL3964332 | 0.71 | BCAT2 (0.57) | SMN1; SMN2SLC6A3SLC6A4 | |
| SCHEMBL10976705 | 0.71 | MAPT (0.46) | CYP1A2CYP2C9CYP2C19CYP3A4GAA | |
| SCHEMBL7630691 | 0.70 | BCAT2 (0.52) | GAAALDH1A1SMN1; SMN2SLC6A3SLC6A4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115124477-B | Novel pyrimidine salicylic acid phenolic ester, synthetic method thereof and application of pyrimidine salicylic acid phenolic ester as herbicide | 中国农业大学 | 2024-05-10 | — | — | CN | disclosed |
| CN-115124477-A | Novel pyrimidine salicylic acid phenolic ester, synthetic method thereof and application thereof as herbicide | 中国农业大学 | 2022-09-30 | — | — | CN | disclosed |