Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 4/20 | 0.39 |
| ▸ | SLC26A6 | Q9BXS9 | 2/20 | 0.39 |
| ▸ | AKT1 | P31749 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | APP | P05067 | 1/20 | 0.37 |
| ▸ | AURKA | O14965 | 1/20 | 0.37 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6439454 | 0.84 | GAA (0.45) | MAPK1SMN1; SMN2GAAMEN1KMT2A | |
| SCHEMBL6414619 | 0.78 | MEN1 (0.46) | MAPK1ACHESLC26A6AKT1SMN1; SMN2 | |
| SCHEMBL6431994 | 0.76 | GAA (0.46) | SMN1; SMN2KDM4EALDH1A1GAAMEN1 | |
| SCHEMBL6436802 | 0.75 | MAPT (0.44) | SMN1; SMN2KDM4EALDH1A1GAAMEN1 | |
| SCHEMBL6435667 | 0.73 | MAPT (0.42) | SMN1; SMN2ALDH1A1GAANPSR1MEN1 | |
| SCHEMBL6435103 | 0.73 | HTT (0.33) | KDM4EALDH1A1KMT2A | |
| SCHEMBL26034950 | 0.72 | KMT2A (0.58) | MAPK1ACHESMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL6435528 | 0.71 | HTT (0.32) | — | |
| SCHEMBL6415904 | 0.69 | LMNA (0.51) | MAPK1ACHESMN1; SMN2KDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL6413439 | 0.68 | LMNA (0.50) | MAPK1ACHESMN1; SMN2KDM4EALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2005044270-A1 | OXADIAZOLOPYRAZINE DERIVATIVES AS PHARMACEUTICALLY ACTIVE COMPOUNDS | 4SC AG (DE) | 2005-05-19 | — | — | WO | disclosed |