Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYMS | P04818 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | CASP1 | P29466 | 1/20 | 0.31 |
| ▸ | CASP7 | P55210 | 1/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL25870521 | 0.98 | TYMS (0.35) | TYMS | |
| SCHEMBL25844909 | 0.95 | TYMS (0.39) | TYMSALDH1A1TSHRMAPK1HSD17B10 | |
| SCHEMBL25870623 | 0.94 | ALDH1A1 (0.33) | TYMSALDH1A1TSHRMAPK1HSD17B10 | |
| SCHEMBL25870373 | 0.94 | TYMS (0.36) | TYMSALDH1A1TSHRMAPK1HSD17B10 | |
| SCHEMBL25844528 | 0.93 | TYMS (0.37) | TYMSALDH1A1TSHRMAPK1HSD17B10 | |
| SCHEMBL25870366 | 0.92 | TYMS (0.35) | TYMS | |
| SCHEMBL25870628 | 0.91 | TYMS (0.33) | TYMS | |
| SCHEMBL25870750 | 0.90 | TYMS (0.39) | TYMSALDH1A1TSHRMAPK1HSD17B10 | |
| SCHEMBL25844900 | 0.90 | TYMS (0.41) | TYMSALDH1A1TSHRMAPK1HSD17B10 | |
| SCHEMBL25844901 | 0.89 | TYMS (0.40) | TYMSALDH1A1TSHRMAPK1HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023120714-A1 | COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE | 出光興産株式会社 | 2023-06-29 | — | — | WO | disclosed |