Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 4/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | PDK1 | Q15118 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
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 Methyl Ester SCHEMBL27338064 | 0.92 | ALDH1A1 (0.48) | ALDH1A1SMN1; SMN2TDP1TSHRMAPK1 | |
| Acrylic Acid Methyl Ester SCHEMBL28067879 | 0.90 | ALDH1A1 (0.47) | ALDH1A1SMN1; SMN2TDP1TSHRMAPK1 | |
| Acrylic Acid Methyl Ester SCHEMBL27759543 | 0.89 | ALDH1A1 (0.46) | ALDH1A1SMN1; SMN2TDP1TSHRMAPK1 | |
| Cyclohexane SCHEMBL16341757 | 0.87 | ALDH1A1 (0.44) | ALDH1A1SMN1; SMN2TDP1TSHRMAPK1 | |
| Acrylic Acid Methyl Ester SCHEMBL27759546 | 0.86 | ALDH1A1 (0.66) | ALDH1A1SMN1; SMN2TDP1TSHRMAPK1 | |
| Acrylic Acid Methyl Ester SCHEMBL28115242 | 0.85 | SMN1; SMN2 (0.63) | ALDH1A1SMN1; SMN2TDP1TSHRPDK1 | |
| Acrylic Acid SCHEMBL17106650 | 0.85 | ALDH1A1 (0.48) | ALDH1A1SMN1; SMN2TDP1TSHRMAPK1 | |
| Acrylic Acid Methyl Ester SCHEMBL566318 | 0.83 | TSHR (0.34) | ALDH1A1TSHRTP53HPGDHIF1A | |
| Acrylic Acid Methyl Ester SCHEMBL25405081 | 0.83 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2TSHRMAPK1TP53 | |
| Acrylic Acid Methyl Ester SCHEMBL28135132 | 0.83 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2TSHRMAPK1TP53 |
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-105764689-A | Surface protection film, method for producing surface protection film, and optical element | 日东电工株式会社 | 2016-07-13 | — | — | CN | disclosed |