Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK2 | O96017 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | PKMYT1 | Q99640 | 1/20 | 0.36 |
| ▸ | SMPD3 | Q9NY59 | 1/20 | 0.36 |
| ▸ | SYK | P43405 | 2/20 | 0.36 |
| ▸ | EEF2K | O00418 | 2/20 | 0.35 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.34 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | NNMT | P40261 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | PDE11A | Q9HCR9 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL30174265 | 0.79 | CYP2A6 (0.43) | CYP3A4CYP2C9EEF2KSIRT3TDP1 | |
| SCHEMBL28966254 | 0.76 | NEK2 (0.43) | CHEK2SYKALDH1A1MAPT | |
| SCHEMBL30174243 | 0.75 | CHEK1 (0.39) | CHEK2EEF2KLRRK2SIRT3TDP1 | |
| SCHEMBL30174194 | 0.74 | CHEK2 (0.45) | CHEK2ALDH1A1MAPT | |
| SCHEMBL30810232 | 0.74 | ACLY (0.37) | CHEK2CYP3A4CYP2C9PKMYT1SMPD3 | |
| SCHEMBL2726309 | 0.74 | CYP3A4 (0.42) | CHEK2CYP3A4CYP2C9PKMYT1EEF2K | |
| SCHEMBL30810193 | 0.74 | HPGD (0.42) | CHEK2CYP3A4CYP2C9PKMYT1EEF2K | |
| SCHEMBL30174264 | 0.73 | NNMT (0.39) | SYKNNMTKMT2A | |
| SCHEMBL30174299 | 0.72 | KDM4E (0.36) | CYP3A4CYP2C9SYKSIRT3TDP1 | |
| SCHEMBL30810276 | 0.72 | PARP1 (0.45) | CHEK2EEF2KALDH1A1LOXL2MEN1 |
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-115605478-A | Compounds and methods of use | 埃克塞里艾克西斯公司（US） | 2023-01-13 | — | — | CN | disclosed |