Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.48 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | GFER | P55789 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.45 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | POLB | P06746 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | AHR | P35869 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL805216 | 0.86 | POLB (0.51) | ALDH1A1MAPTGFERSMN1; SMN2HSD17B10 | |
| SCHEMBL12853005 | 0.86 | EGFR (0.55) | ALDH1A1CYP2C9RXFP1MAPTSMN1; SMN2 | |
| SCHEMBL12852646 | 0.84 | POLB (0.55) | ALDH1A1CYP2C9RXFP1MAPTGFER | |
| SCHEMBL13973827 | 0.84 | KMT2A (0.50) | ALDH1A1CYP2C9RXFP1MAPTGFER | |
| SCHEMBL130408 | 0.84 | ALDH1A1 (0.64) | ALDH1A1MAPTSMN1; SMN2HTTKCNK3 | |
| SCHEMBL14545526 | 0.81 | ALDH1A1 (0.47) | ALDH1A1CYP2C9RXFP1MAPTGFER | |
| SCHEMBL12852657 | 0.81 | LRRK2 (0.42) | ALDH1A1CYP2C9RXFP1MAPTGFER | |
| SCHEMBL12852698 | 0.79 | MAPT (0.52) | ALDH1A1MAPTSMN1; SMN2KMT2AMEN1 | |
| SCHEMBL30482833 | 0.77 | SRC (0.58) | ALDH1A1CYP2C9MAPTSMN1; SMN2HSD17B10 | |
| SCHEMBL1210111 | 0.77 | SRC (0.58) | ALDH1A1CYP2C9MAPTSMN1; SMN2HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2014643-B1 | PARA-METHOXYANILINE DERIVATIVES INCREASING THE ANTIKNOCK RATING OF HYDROCARBON FUELS AND COMPOSITIONS BASED THEREON | ZAO IFOKHIM (RU) | 2013-11-20 | — | — | EP | disclosed |
| EP-2014643-A1 | PARA-ETHOXYANILINE DERIVATIVES INCREASING THE ANTIKNOCK RATING OF HYDROCARBON FUELS AND COMPOSITIONS BASED THEREON | Obshestvo S Ogranichennoy Otvetstvennostiu Inoxim (RU) | 2009-01-14 | — | — | EP | disclosed |