Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 3/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.45 |
| ▸ | HPGD | P15428 | 5/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.45 |
| ▸ | NAPRT | Q6XQN6 | 3/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | BLM | P54132 | 2/20 | 0.45 |
| ▸ | ESR1 | P03372 | 1/20 | 0.45 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.45 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.45 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.45 |
| ▸ | GGT1 | P19440 | 1/20 | 0.45 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL30867034 | 0.93 | HTT (0.56) | HTTALDH1A1KMT2APTK2BKDM4E | |
| SCHEMBL118736 | 0.93 | HTT (0.56) | HTTALDH1A1KMT2APTK2BKDM4E | |
| SCHEMBL9275209 | 0.81 | ELANE (0.44) | HTTALDH1A1KMT2AKDM4ETDP1 | |
| SCHEMBL31087893 | 0.80 | HTT (0.43) | HTTALDH1A1KMT2APTK2BKDM4E | |
| SCHEMBL29947318 | 0.79 | HTT (0.59) | HTTALDH1A1KMT2APTK2BKDM4E | |
| SCHEMBL8802603 | 0.79 | MAPK1 (0.46) | HTTALDH1A1KMT2APTK2BKDM4E | |
| SCHEMBL27462073 | 0.78 | ALDH1A1 (0.50) | HTTALDH1A1KMT2APTK2BKDM4E | |
| SCHEMBL9592615 | 0.78 | CTNNB1 (0.61) | HTTALDH1A1KMT2AKDM4EHPGD | |
| SCHEMBL29286 | 0.77 | KDM4E (0.44) | HTTALDH1A1KMT2APTK2BKDM4E | |
| SCHEMBL29805855 | 0.77 | HTT (0.50) | HTTALDH1A1KMT2APTK2BKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| 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 | claimed |