Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | TRIM24 | O15164 | 2/20 | 0.35 |
| ▸ | TRIM33 | Q9UPN9 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.32 |
| ▸ | PDE4A | P27815 | 1/20 | 0.31 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.31 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.31 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | DAO | P14920 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.31 |
| ▸ | KMO | O15229 | 1/20 | 0.30 |
| ▸ | ATM | Q13315 | 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 | |
|---|---|---|---|---|
| SCHEMBL29649216 | 0.89 | MAPT (0.36) | ESR2TRIM24TRIM33ALDH1A1PDE4A | |
| SCHEMBL30995000 | 0.89 | MAPT (0.36) | ESR2TRIM24TRIM33ALDH1A1PDE4A | |
| SCHEMBL30463126 | 0.86 | KMT2A (0.38) | ALDH1A1KMT2AHAO1KMO | |
| SCHEMBL2382277 | 0.86 | KMT2A (0.38) | ALDH1A1KMT2AHAO1KMO | |
| SCHEMBL2765846 | 0.86 | KMT2A (0.38) | ALDH1A1KMT2AHAO1KMO | |
| SCHEMBL389567 | 0.86 | KMT2A (0.38) | ALDH1A1KMT2AHAO1KMO | |
| SCHEMBL27733991 | 0.84 | ESR2 (0.40) | ESR2PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL27721928 | 0.84 | KMT2A (0.37) | ALDH1A1KMT2AHAO1KMO | |
| Water SCHEMBL2398687 | 0.84 | KMT2A (0.37) | ALDH1A1KMT2AHAO1KMO | |
| SCHEMBL27742479 | 0.84 | KMT2A (0.37) | ALDH1A1KMT2AHAO1KMO |
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-118084923-A | Cyclic compounds as LRRK2 kinase inhibitors and methods of making the same | 中国科学院上海有机化学研究所 | 2024-05-28 | — | — | CN | disclosed |