Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | ELANE | P08246 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CASP6 | P55212 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11259539 | 0.82 | CYP2C19 (0.39) | CYP2C19TSHRATMADAM17MEN1 | |
| SCHEMBL28873103 | 0.82 | CYP2C19 (0.39) | CYP2C19TSHRKMT2ALMNASMN1; SMN2 | |
| SCHEMBL28873098 | 0.77 | SLC6A1 (0.32) | CYP2C19TSHRGAAMEN1KMT2A | |
| SCHEMBL28873132 | 0.75 | PRMT5 (0.33) | CYP2C19TSHRGAAMEN1KMT2A | |
| SCHEMBL28873100 | 0.74 | P2RX7 (0.35) | MEN1KMT2ALMNA | |
| SCHEMBL10609425 | 0.72 | ALDH1A1 (0.43) | GAAMEN1KMT2ALMNA | |
| SCHEMBL28873109 | 0.72 | PRMT5 (0.40) | CYP2C19GAAMEN1KMT2A | |
| SCHEMBL20332078 | 0.71 | ADAM17 (0.41) | CYP2C19TSHRATMADAM17MEN1 | |
| SCHEMBL632647 | 0.69 | PDK2 (0.37) | CYP2C19GAAMEN1KMT2A | |
| SCHEMBL20241797 | 0.69 | ADAM17 (0.37) | CYP2C19TSHRATMADAM17MEN1 |
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-110372625-B | Method for preparing 4-alkyl methyl-4-aryl-1,3-benzoxazine-2 (4H) -ketone by blue light irradiation | 常州大学 | 2022-11-01 | — | — | CN | disclosed |