Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSPA5 | P11021 | 2/20 | 0.66 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.49 |
| ▸ | TSHR | P16473 | 4/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.49 |
| ▸ | LMNA | P02545 | 4/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.49 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 3/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | BLM | P54132 | 2/20 | 0.49 |
| ▸ | ATM | Q13315 | 2/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.49 |
| ▸ | GMNN | O75496 | 1/20 | 0.49 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.49 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL57329 | 0.89 | HSPA5 (0.82) | HSPA5ALDH1A1TSHRKMT2ALMNA | |
| SCHEMBL10822059 | 0.87 | HSPA5 (0.64) | HSPA5ALDH1A1TSHRKMT2ALMNA | |
| SCHEMBL8114199 | 0.87 | HSPA5 (0.73) | HSPA5ALDH1A1TSHRKMT2ALMNA | |
| SCHEMBL2349337 | 0.87 | HSPA5 (0.73) | HSPA5ALDH1A1TSHRKMT2ALMNA | |
| SCHEMBL3809095 | 0.86 | HSPA5 (0.62) | HSPA5ALDH1A1TSHRKMT2ALMNA | |
| SCHEMBL10878501 | 0.86 | HSPA5 (0.57) | HSPA5ALDH1A1TSHRKMT2ALMNA | |
| SCHEMBL18902069 | 0.85 | HSPA5 (0.71) | HSPA5ALDH1A1TSHRKMT2ALMNA | |
| Alcohol SCHEMBL9286265 | 0.84 | ALDH1A1 (0.60) | HSPA5ALDH1A1TSHRKMT2ALMNA | |
| SCHEMBL42656 | 0.84 | ALDH1A1 (0.64) | HSPA5ALDH1A1TSHRKMT2ALMNA | |
| SCHEMBL10821851 | 0.84 | HSPA5 (0.64) | HSPA5ALDH1A1TSHRKMT2ALMNA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0163635-A4 | PROCESS FOR PREPARING SUBSTITUTED BENZYL MALONIC ACID ESTERS. | ETHYL CORP (US) | 1986-04-02 | — | — | EP | disclosed |
| EP-0163635-A1 | PROCESS FOR PREPARING SUBSTITUTED BENZYL MALONIC ACID ESTERS | ETHYL CORPORATION (US) | 1985-12-11 | — | — | EP | disclosed |
| WO-1985002182-A1 | PROCESS FOR PREPARING SUBSTITUTED BENZYL MALONIC ACID ESTERS | ETHYL CORPORATION (US) | 1985-05-23 | — | — | WO | disclosed |
| US-4463186-A | Process for the preparation of 3,5-dihydrocarbyl-4-hydroxybenzylmalonic acid esters | ETHYL CORPORATION (US) | 1984-07-31 | — | — | US | disclosed |