Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | TYR | P14679 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.33 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.33 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.33 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.33 |
| ▸ | DAO | P14920 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA7 | P43166 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1028256 | 0.87 | ALDH1A1 (0.54) | ALDH1A1CYP1A2CYP2C19TYRACHE | |
| SCHEMBL1028255 | 0.87 | ALDH1A1 (0.54) | ALDH1A1CYP1A2CYP2C19TYRACHE | |
| SCHEMBL3969320 | 0.87 | ALDH1A1 (0.54) | ALDH1A1CYP1A2CYP2C19TYRACHE | |
| SCHEMBL8694270 | 0.81 | ALDH1A1 (0.46) | ALDH1A1CYP1A2CYP2C19KMT2AMEN1 | |
| SCHEMBL8694272 | 0.81 | ALDH1A1 (0.46) | ALDH1A1CYP1A2CYP2C19KMT2AMEN1 | |
| SCHEMBL16569580 | 0.74 | ALDH1A1 (0.54) | ALDH1A1CYP1A2CYP2C19TYRPARP10 | |
| SCHEMBL8691442 | 0.74 | ALDH1A1 (0.54) | ALDH1A1CYP1A2CYP2C19TYRKMT2A | |
| SCHEMBL16578874 | 0.74 | ALDH1A1 (0.54) | ALDH1A1CYP1A2CYP2C19TYRPARP10 | |
| SCHEMBL31158452 | 0.74 | ALDH1A1 (0.54) | ALDH1A1CYP1A2CYP2C19TYRPARP10 | |
| SCHEMBL8691444 | 0.74 | ALDH1A1 (0.54) | ALDH1A1CYP1A2CYP2C19TYRKMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117642375-A | Indenone and tetralone-ketone or hydroxyoxime as cancer therapeutic agents | 德克萨斯大学系统董事会 | 2024-03-01 | — | — | CN | claimed |
| CN-117642375-A | Indenone and tetralone-ketone or hydroxyoxime as cancer therapeutic agents | 德克萨斯大学系统董事会 | 2024-03-01 | — | — | CN | disclosed |