Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.79 |
| ▸ | MGAM | O43451 | 1/20 | 0.79 |
| ▸ | SI | P14410 | 1/20 | 0.79 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.79 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.50 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.50 |
| ▸ | LDHA | P00338 | 1/20 | 0.47 |
| ▸ | SRR | Q9GZT4 | 1/20 | 0.47 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.42 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.42 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Malonic Acid Diethyl Ester SCHEMBL18911581 | 1.00 | GAA (0.79) | GAAMGAMSIMGAM2ALDH1A1 | |
| Malonic Acid Diethyl Ester SCHEMBL28844893 | 0.95 | GAA (0.79) | GAAMGAMSIMGAM2ALDH1A1 | |
| Malonic Acid Diethyl Ester SCHEMBL9684546 | 0.93 | GAA (0.68) | GAAMGAMSIMGAM2ALDH1A1 | |
| SCHEMBL30741390 | 0.92 | GAA (0.74) | GAAMGAMSIMGAM2ALDH1A1 | |
| SCHEMBL15376 | 0.92 | — | — | |
| SCHEMBL13278763 | 0.90 | GAA (0.70) | GAAMGAMSIMGAM2ALDH1A1 | |
| SCHEMBL3196229 | 0.90 | GAA (0.70) | GAAMGAMSIMGAM2ALDH1A1 | |
| SCHEMBL1068040 | 0.90 | GAA (0.70) | GAAMGAMSIMGAM2ALDH1A1 | |
| Water SCHEMBL2811574 | 0.90 | GAA (0.70) | GAAMGAMSIMGAM2ALDH1A1 | |
| SCHEMBL11097044 | 0.90 | GAA (0.70) | GAAMGAMSIMGAM2ALDH1A1 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5948945-A | Prevention of spontaneous decomposition of gaseous acetylene | BASF AKTIENGESELLSCHAFT (DE) | 1999-09-07 | — | — | US | claimed |
| CN-106565455-B | Electron level malonic acid | 宿迁南翔化学品制造有限公司 | 2019-08-06 | — | — | CN | disclosed |
| EP-3387099-A1 | FOOD CONTACT SURFACE SANITIZING LIQUID | The Clorox Company (US) | 2018-10-17 | — | — | EP | disclosed |
| WO-2017099964-A1 | FOOD CONTACT SURFACE SANITIZING LIQUID | THE CLOROX COMPANY (US) | 2017-06-15 | — | — | WO | disclosed |
| CN-106565455-A | Electronic grade malonic acid | 宿迁南翔化学品制造有限公司 | 2017-04-19 | — | — | CN | disclosed |
| CN-104086540-A | Preparation method for 5,6-DIHYDRO-1H-PYRIDIN-2-ONE COMPOUNDS | ANADYS PHARMACEUTICALS INC | 2014-10-08 | — | — | CN | disclosed |
| CN-102985159-A | method for capturing carbon dioxide | UNIV LEEDS | 2013-03-20 | — | — | CN | disclosed |