Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 5/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 4/20 | 0.36 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | EGLN1 | Q9GZT9 | 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 | |
|---|---|---|---|---|
| Acrolein SCHEMBL11766257 | 0.93 | ALDH1A1 (0.42) | HCAR2THRBTSHRGLO1ALDH1A1 | |
| Butadiene SCHEMBL11410298 | 0.87 | HCAR2 (0.52) | HCAR2TSHRGLO1ALDH1A1CYP2D6 | |
| Methacrylic Acid SCHEMBL3440748 | 0.85 | HCAR2 (0.50) | HCAR2THRBTSHRGLO1ALDH1A1 | |
| SCHEMBL40331 | 0.85 | HCAR2 (0.57) | HCAR2TSHRGLO1ALDH1A1CYP2D6 | |
| Maleic Acid SCHEMBL15653018 | 0.85 | HCAR2 (0.57) | HCAR2THRBTSHRGLO1ALDH1A1 | |
| Maleic Acid SCHEMBL720767 | 0.85 | HCAR2 (0.57) | HCAR2THRBTSHRGLO1ALDH1A1 | |
| Fumaric Acid SCHEMBL8953356 | 0.85 | HCAR2 (0.57) | HCAR2THRBTSHRGLO1ALDH1A1 | |
| SCHEMBL770780 | 0.84 | ALDH1A1 (0.48) | HCAR2THRBTSHRGLO1ALDH1A1 | |
| Acrylic Acid SCHEMBL11216503 | 0.84 | HCAR2 (0.52) | HCAR2TSHRGLO1ALDH1A1CYP2D6 | |
| Methacrylic Acid SCHEMBL8982580 | 0.82 | ALDH1A1 (0.46) | HCAR2THRBTSHRGLO1ALDH1A1 |
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-4016127-A | Emulsion copolymers of acrolein and their use in treating leather | ROHM AND HAAS COMPANY (US) | 1977-04-05 | — | — | US | disclosed |