Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | AKT1 | P31749 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3918092 | 0.80 | ALDH1A1 (0.41) | ALDH1A1TSHRKCNN4CYP2C19HIF1A | |
| SCHEMBL20972999 | 0.75 | KCNN4 (0.45) | ALDH1A1TSHRKCNN4CYP2C19HIF1A | |
| SCHEMBL14878271 | 0.75 | KCNN4 (0.45) | ALDH1A1TSHRKCNN4CYP2C19HIF1A | |
| SCHEMBL8324538 | 0.73 | CYP2C19 (0.48) | ALDH1A1TSHRKCNN4CYP2C19HIF1A | |
| SCHEMBL28018516 | 0.73 | KDM4E (0.39) | ALDH1A1TSHRKCNN4CYP2C19HTT | |
| SCHEMBL1096837 | 0.72 | KCNN4 (0.47) | ALDH1A1TSHRKCNN4CYP2C19HIF1A | |
| SCHEMBL5666953 | 0.72 | KCNN4 (0.47) | ALDH1A1TSHRKCNN4CYP2C19HIF1A | |
| SCHEMBL11379208 | 0.72 | CYP2C19 (0.52) | ALDH1A1TSHRKCNN4CYP2C19HIF1A | |
| SCHEMBL14800032 | 0.72 | CYP1A2 (0.44) | ALDH1A1TSHRKCNN4CYP2C19HIF1A | |
| SCHEMBL5171119 | 0.72 | CYP1A2 (0.44) | ALDH1A1TSHRKCNN4CYP2C19HIF1A |
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 |
|---|---|---|---|---|---|---|---|
| CN-114849679-B | Solid super acid supported catalyst and preparation method of beta-phenethyl alcohol | 万华化学集团股份有限公司 | 2024-02-02 | — | — | CN | disclosed |
| CN-114849679-A | Solid superacid supported catalyst and preparation method of beta-phenethyl alcohol | 万华化学集团股份有限公司 | 2022-08-05 | — | — | CN | disclosed |