Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 4/20 | 0.44 |
| ▸ | BCHE | P06276 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | ALDH2 | P05091 | 2/20 | 0.41 |
| ▸ | ALDH3A1 | P30838 | 2/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.41 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.41 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.41 |
| ▸ | CDC25A | P30304 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL31147117 | 0.91 | CYP1A2 (0.42) | CES1BCHEALDH1A1ALDH2ALDH3A1 | |
| SCHEMBL18133607 | 0.81 | ALDH1A1 (0.44) | CES1BCHEALDH1A1ALDH2ALDH3A1 | |
| SCHEMBL31337501 | 0.78 | PIM1 (0.49) | ALDH1A1LMNASMN1; SMN2CYP1A2CYP2D6 | |
| SCHEMBL31337484 | 0.78 | KMT2A (0.39) | ALDH1A1HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL31337334 | 0.78 | KMT2A (0.41) | ALDH1A1ALDH2ALDH3A1HDAC3HDAC4 | |
| SCHEMBL31337518 | 0.78 | KMT2A (0.39) | ALDH1A1HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL31337428 | 0.77 | KMT2A (0.39) | ALDH1A1HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL29025681 | 0.75 | CYP2D6 (0.64) | ALDH1A1HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL19754284 | 0.75 | CES1 (0.48) | CES1BCHEALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL11148969 | 0.74 | CES1 (0.78) | CES1BCHEALDH1A1ALDH2ALDH3A1 |
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-119552191-A | Spirocyclic aromatic hydrocarbon phosphonic acid derivative containing crisscross structure, preparation method and application thereof in photoelectric device | 浙江省白马湖实验室有限公司 | 2025-03-04 | — | — | CN | disclosed |