Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Methacrylic Acid SCHEMBL25365789 | 1.00 | ALDH1A1 (0.34) | ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2 | |
| Methacrylic Acid SCHEMBL1485968 | 0.94 | TGFBR1 (0.32) | ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2 | |
| Methacrylic Acid SCHEMBL443711 | 0.94 | TGFBR1 (0.32) | ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2 | |
| Methacrylic Acid SCHEMBL1974753 | 0.94 | TGFBR1 (0.32) | ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2 | |
| Methacrylic Acid SCHEMBL27649 | 0.94 | TGFBR1 (0.32) | ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2 | |
| Methacrylic Acid SCHEMBL11006034 | 0.94 | TGFBR1 (0.32) | ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2 | |
| Methacrylic Acid SCHEMBL36868 | 0.94 | TGFBR1 (0.32) | ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2 | |
| Methacrylic Acid SCHEMBL9194150 | 0.94 | TGFBR1 (0.32) | ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2 | |
| Methacrylic Acid SCHEMBL4878336 | 0.94 | TGFBR1 (0.32) | ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2 | |
| Methacrylic Acid SCHEMBL64985 | 0.94 | TGFBR1 (0.32) | ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2 |
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-109825088-A | A kind of silicon rubber base flexibility neutron shielding material and preparation method thereof | 中国工程物理研究院核物理与化学研究所 | 2019-05-31 | — | — | CN | disclosed |