Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | THPO | P40225 | 1/20 | 0.46 |
| ▸ | MTOR | P42345 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | HBB | P68871 | 1/20 | 0.46 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | DPYD | Q12882 | 4/20 | 0.37 |
| ▸ | ATAD2 | Q6PL18 | 1/20 | 0.37 |
| ▸ | RHEB | Q15382 | 1/20 | 0.37 |
| ▸ | TYMP | P19971 | 1/20 | 0.37 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.36 |
| ▸ | TYMS | P04818 | 2/20 | 0.36 |
| ▸ | PNP | P00491 | 1/20 | 0.35 |
| ▸ | DHFR | P00374 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28412370 | 0.83 | MCL1 (0.44) | ALDH1A1LMNAMAPTCYP19A1TSHR | |
| SCHEMBL28417137 | 0.83 | GAA (0.46) | ALDH1A1LMNAMAPTCYP19A1TSHR | |
| SCHEMBL11616697 | 0.83 | ATAD2 (0.50) | ALDH1A1LMNAMAPTCYP19A1TSHR | |
| SCHEMBL28421433 | 0.79 | IDO1 (0.48) | ALDH1A1LMNAATAD2TYMS | |
| SCHEMBL28408958 | 0.79 | HTR1A (0.38) | ALDH1A1LMNAMAPTCYP19A1TSHR | |
| SCHEMBL28412020 | 0.76 | TYMS (0.44) | ALDH1A1DPYDRHEBTYMSDHFR | |
| SCHEMBL4566130 | 0.72 | DAO (0.43) | ALDH1A1LMNAMAPTCYP19A1TSHR | |
| SCHEMBL10509275 | 0.71 | MAPT (0.52) | ALDH1A1LMNAMAPTCYP19A1TSHR | |
| SCHEMBL11617247 | 0.71 | IDO1 (0.50) | ALDH1A1LMNASMN1; SMN2ATAD2NOTUM | |
| SCHEMBL16652924 | 0.69 | ALDH1A1 (0.67) | ALDH1A1LMNAMAPTCYP19A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-111705329-B | Electrochemical synthesis method of 5-arylthio uracil compound | 湖南科技学院 | 2021-07-02 | — | — | CN | disclosed |
| CN-111705329-A | Electrochemical synthesis method of 5-arylthio uracil compound | 湖南科技学院 | 2020-09-25 | — | — | CN | disclosed |
| CN-109651267-B | Method for preparing 5-sulfur/selenium modified uracil derivative | 中国科学院化学研究所 | 2020-05-19 | — | — | CN | disclosed |