Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 2/20 | 0.68 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.68 |
| ▸ | LMNA | P02545 | 1/20 | 0.68 |
| ▸ | ALB | P02768 | 1/20 | 0.68 |
| ▸ | TSHR | P16473 | 1/20 | 0.68 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.68 |
| ▸ | FBP1 | P09467 | 10/20 | 0.65 |
| ▸ | GHSR | Q92847 | 1/20 | 0.63 |
| ▸ | EPHX1 | P07099 | 3/20 | 0.60 |
| ▸ | HTT | P42858 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL19271872 | 1.00 | EPHX2 (0.68) | EPHX2CYP2C9ALDH1A1LMNAALB | |
| SCHEMBL11049679 | 0.98 | CYP2C9 (0.69) | EPHX2CYP2C9ALDH1A1LMNAALB | |
| SCHEMBL184964 | 0.94 | CYP2C9 (0.76) | EPHX2CYP2C9ALDH1A1LMNAALB | |
| Methyl Alcohol SCHEMBL28260710 | 0.93 | CYP2C9 (0.74) | EPHX2CYP2C9ALDH1A1LMNAALB | |
| SCHEMBL5931108 | 0.92 | FBP1 (0.70) | EPHX2CYP2C9ALDH1A1LMNAALB | |
| SCHEMBL2290886 | 0.88 | ALDH1A1 (0.72) | EPHX2CYP2C9ALDH1A1LMNAALB | |
| SCHEMBL23876511 | 0.87 | ALDH1A1 (0.89) | CYP2C9ALDH1A1LMNAALBTSHR | |
| SCHEMBL5931121 | 0.87 | ALDH1A1 (0.89) | CYP2C9ALDH1A1LMNAALBTSHR | |
| SCHEMBL29787228 | 0.87 | ALDH1A1 (0.89) | CYP2C9ALDH1A1LMNAALBTSHR | |
| SCHEMBL8668492 | 0.87 | ALDH1A1 (0.89) | CYP2C9ALDH1A1LMNAALBTSHR |
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-112472822-B | Construction and application of endoplasmic reticulum targeted nano drug delivery system | 浙江大学 | 2022-05-27 | — | — | CN | disclosed |
| CN-112472822-A | Construction and application of endoplasmic reticulum targeted nano drug delivery system | 浙江大学 | 2021-03-12 | — | — | CN | disclosed |