Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.62 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 3/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 2/20 | 0.31 |
| ▸ | MGLL | Q99685 | 1/20 | 0.30 |
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 SCHEMBL28555715 | 0.94 | ALDH1A1 (0.68) | ALDH1A1CYP3A4TP53TSHRCYP2D6 | |
| SCHEMBL11684738 | 0.92 | ALDH1A1 (0.73) | ALDH1A1CYP3A4TP53TSHRCYP2D6 | |
| Methacrylic Acid SCHEMBL8653129 | 0.91 | ALDH1A1 (0.68) | ALDH1A1CYP3A4TP53TSHRCYP2D6 | |
| Acrylic Acid SCHEMBL8653521 | 0.88 | ALDH1A1 (0.68) | ALDH1A1CYP3A4TP53TSHRCYP2D6 | |
| Acrylic Acid SCHEMBL527679 | 0.88 | ALDH1A1 (0.81) | ALDH1A1CYP3A4TP53TSHRCYP2D6 | |
| Acrylic Acid SCHEMBL28547922 | 0.88 | ALDH1A1 (0.81) | ALDH1A1CYP3A4TP53TSHRCYP2D6 | |
| Acrylic Acid SCHEMBL29290890 | 0.87 | ALDH1A1 (0.73) | ALDH1A1CYP3A4TP53TSHRCYP2D6 | |
| Acrylic Acid SCHEMBL9275734 | 0.87 | ALDH1A1 (0.78) | ALDH1A1CYP3A4TP53TSHRCYP2D6 | |
| Acrylic Acid SCHEMBL29014580 | 0.84 | ALDH1A1 (0.69) | ALDH1A1CYP3A4TP53TSHRCYP2D6 | |
| Acrylic Acid SCHEMBL29015103 | 0.84 | ALDH1A1 (0.73) | 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 |
|---|---|---|---|---|---|---|---|
| US-5780578-A | Synthetic polymer exhibiting hydrolytic activity, its preparation and use for conversion of esters and amides to the corresponding alcohol and amine | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 1998-07-14 | — | — | US | claimed |