Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR52 | Q9Y2T5 | 12/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | ADH1B | P00325 | 1/20 | 0.37 |
| ▸ | ADH1C | P00326 | 1/20 | 0.37 |
| ▸ | ADH1A | P07327 | 1/20 | 0.37 |
| ▸ | ADH7 | P40394 | 1/20 | 0.37 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Dihydrocinnamaldehyde SCHEMBL8109306 | 0.91 | ADH1B (0.43) | GPR52ALDH1A1KEAP1ADH1BADH1C | |
| Dihydrocinnamaldehyde SCHEMBL29052009 | 0.85 | TDP1 (0.48) | GPR52ALDH1A1KEAP1TDP1ADH1B | |
| Dihydrocinnamaldehyde SCHEMBL1335 | 0.82 | ADH1B (0.50) | GPR52ALDH1A1KEAP1TDP1ADH1B | |
| Butanal SCHEMBL4564646 | 0.81 | ADRA1A (0.41) | ALDH1A1TDP1 | |
| Propionaldehyde SCHEMBL4564588 | 0.81 | GABRA1 (0.35) | ALDH1A1TDP1 | |
| Dihydrocinnamaldehyde SCHEMBL19810527 | 0.80 | ADH1B (0.48) | GPR52ALDH1A1KEAP1TDP1ADH1B | |
| Dihydrocinnamaldehyde SCHEMBL11053918 | 0.80 | ADH1B (0.48) | GPR52ALDH1A1KEAP1TDP1ADH1B | |
| Dihydrocinnamaldehyde SCHEMBL5791873 | 0.80 | ADH1B (0.48) | GPR52ALDH1A1KEAP1TDP1ADH1B | |
| Dihydrocinnamaldehyde SCHEMBL11053817 | 0.80 | ADH1B (0.48) | GPR52ALDH1A1KEAP1TDP1ADH1B | |
| Propionaldehyde SCHEMBL4564022 | 0.79 | PPARG (0.33) | ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7612148-B2 | Hydrogenation catalyst composition and method for hydrogenation of conjugated diene polymer | TSRC CORPORATION (TW) | 2009-11-03 | — | — | US | disclosed |
| US-20080146733-A1 | Hydrogenation catalyst composition and method for hydrogenation of conjugated diene polymer | TSRC CORPORATION (TW) | 2008-06-19 | — | — | US | disclosed |