Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.69 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | MGLL | Q99685 | 3/20 | 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 | |
|---|---|---|---|---|
| Acrylic Acid SCHEMBL29290890 | 0.97 | ALDH1A1 (0.73) | ALDH1A1CYP3A4TP53TSHRCYP2D6 | |
| Acrylic Acid SCHEMBL28547922 | 0.93 | ALDH1A1 (0.81) | ALDH1A1CYP3A4TP53TSHRCYP2D6 | |
| Acrylic Acid SCHEMBL527679 | 0.93 | ALDH1A1 (0.81) | ALDH1A1CYP3A4TP53TSHRCYP2D6 | |
| Acrylic Acid SCHEMBL9275734 | 0.91 | ALDH1A1 (0.78) | ALDH1A1CYP3A4TP53TSHRCYP2D6 | |
| Acrylic Acid SCHEMBL29065816 | 0.89 | ALDH1A1 (0.73) | ALDH1A1CYP3A4TP53TSHRCYP2D6 | |
| Acrylic Acid SCHEMBL29015103 | 0.89 | ALDH1A1 (0.73) | ALDH1A1CYP3A4TP53TSHRCYP2D6 | |
| Ethylene Glycol SCHEMBL27586881 | 0.88 | ALDH1A1 (0.89) | ALDH1A1CYP3A4TP53TSHRCYP2D6 | |
| Ethylene Glycol SCHEMBL27817364 | 0.88 | ALDH1A1 (0.89) | ALDH1A1CYP3A4TP53TSHRCYP2D6 | |
| Acrylic Acid SCHEMBL28555715 | 0.88 | ALDH1A1 (0.68) | ALDH1A1CYP3A4TP53TSHRCYP2D6 | |
| Acrylic Acid Methyl Ester SCHEMBL28500509 | 0.88 | ALDH1A1 (0.68) | ALDH1A1CYP3A4TP53TSHRCYP2D6 |
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-116082581-A | Silicon hydrogel material | 烟台爱博诺德医用材料有限公司 | 2023-05-09 | — | — | CN | disclosed |