Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | NAAA | Q02083 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CES2 | O00748 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.34 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.34 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 4/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 3/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9334323 | 0.88 | ALDH1A1 (0.39) | EPHX2ALDH1A1KMT2ATSHR | |
| SCHEMBL9334357 | 0.88 | ALDH1A1 (0.39) | EPHX2ALDH1A1KMT2ATSHR | |
| SCHEMBL9333535 | 0.87 | TSHR (0.41) | EPHX2ALDH1A1THRBCA2CYP3A4 | |
| SCHEMBL540169 | 0.87 | TSHR (0.41) | EPHX2ALDH1A1THRBCA2CYP3A4 | |
| SCHEMBL1277874 | 0.87 | TSHR (0.41) | EPHX2ALDH1A1THRBCA2CYP3A4 | |
| SCHEMBL9333564 | 0.87 | TSHR (0.41) | EPHX2ALDH1A1THRBCA2CYP3A4 | |
| SCHEMBL9333256 | 0.87 | TSHR (0.41) | EPHX2ALDH1A1THRBCA2CYP3A4 | |
| SCHEMBL8746586 | 0.87 | TSHR (0.41) | EPHX2ALDH1A1THRBCA2CYP3A4 | |
| SCHEMBL9333587 | 0.87 | TSHR (0.41) | EPHX2ALDH1A1THRBCA2CYP3A4 | |
| SCHEMBL9182313 | 0.85 | ALDH1A1 (0.48) | ALDH1A1NAAACYP3A4TSHREPHX1 |
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-112724088-B | Uracil compound and anti-tumor application thereof | 中国医学科学院医药生物技术研究所 | 2022-04-29 | — | — | CN | disclosed |
| CN-112724088-A | Uracil compound and anti-tumor application thereof | 中国医学科学院医药生物技术研究所 | 2021-04-30 | — | — | CN | disclosed |
| CN-112618550-A | Antineoplastic uracil compound and lipid composition thereof | 中国医学科学院医药生物技术研究所 | 2021-04-09 | — | — | CN | disclosed |