Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 6/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 3/20 | 0.36 |
| ▸ | PARP1 | P09874 | 1/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | CACNB4 | O00305 | 1/20 | 0.34 |
| ▸ | CACNA1A | O00555 | 1/20 | 0.34 |
| ▸ | CACNA1G | O43497 | 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 | |
|---|---|---|---|---|
| SCHEMBL5880357 | 0.85 | KDM4E (0.48) | ACHECYP1A2CYP2C9KDM4EALDH1A1 | |
| SCHEMBL6236293 | 0.76 | CYP1A2 (0.39) | ACHECYP1A2CYP2C9KDM4EALDH1A1 | |
| SCHEMBL26617701 | 0.72 | KDM4E (0.47) | ACHECYP1A2CYP2C9KDM4EALDH1A1 | |
| SCHEMBL30681964 | 0.72 | KDM4E (0.47) | ACHECYP1A2CYP2C9KDM4EALDH1A1 | |
| SCHEMBL26617997 | 0.71 | KDM4E (0.46) | ACHECYP1A2KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL31345638 | 0.71 | KDM4E (0.46) | ACHECYP1A2KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL9014873 | 0.70 | KDM4E (0.45) | ACHECYP1A2KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL21572852 | 0.69 | ALDH1A1 (0.56) | CYP1A2KDM4EALDH1A1SMN1; SMN2KMT2A | |
| SCHEMBL2410364 | 0.69 | KDM4E (0.41) | ACHECYP1A2CYP2C9KDM4EALDH1A1 | |
| SCHEMBL2408933 | 0.69 | KDM4E (0.41) | ACHECYP1A2CYP2C9KDM4EALDH1A1 |
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-1587796-A1 | SATURATED QUINOXALINE DERIVATIVES AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR LIGANDS | AstraZeneca AB (SE) | 2005-10-26 | — | — | EP | disclosed |
| WO-2004069813-A1 | SATURATED QUINOXALINE DERIVATIVES AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR LIGANDS | ASTRAZENECA AB (SE) | 2004-08-19 | — | — | WO | disclosed |