Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | EPHX2 | P34913 | 10/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | CYP27A1 | Q02318 | 1/20 | 0.35 |
| ▸ | CYP24A1 | Q07973 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL581437 | 0.96 | KDM4E (0.50) | KDM4EALDH1A1EPHX2SLC6A2SLC6A4 | |
| SCHEMBL3075831 | 0.96 | KDM4E (0.50) | KDM4EALDH1A1EPHX2SLC6A2SLC6A4 | |
| SCHEMBL581424 | 0.96 | KDM4E (0.50) | KDM4EALDH1A1EPHX2SLC6A2SLC6A4 | |
| SCHEMBL581930 | 0.90 | KDM4E (0.46) | KDM4EALDH1A1EPHX2CYP2C9GAA | |
| SCHEMBL582199 | 0.85 | ALDH1A1 (0.43) | KDM4EALDH1A1MEN1KMT2AL3MBTL1 | |
| SCHEMBL581773 | 0.85 | ALDH1A1 (0.43) | KDM4EALDH1A1MEN1KMT2AL3MBTL1 | |
| SCHEMBL3073509 | 0.85 | ALDH1A1 (0.43) | KDM4EALDH1A1MEN1KMT2AL3MBTL1 | |
| SCHEMBL3072810 | 0.82 | NPSR1 (0.43) | ALDH1A1GAAMEN1KMT2AL3MBTL1 | |
| SCHEMBL581342 | 0.82 | NPSR1 (0.43) | ALDH1A1GAAMEN1KMT2AL3MBTL1 | |
| SCHEMBL587229 | 0.82 | KDM4E (0.48) | KDM4EALDH1A1EPHX2CYP2C9POLB |
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-2417131-A1 | ISOXAZOL-3(2H)-ONE ANALOGS AS THERAPEUTIC AGENTS | AstraZeneca AB (SE) | 2012-02-15 | — | — | EP | disclosed |
| WO-2010117323-A1 | METHOD AND APPARATUS FOR PRODUCING HEAT ENERGY AND CARBON DIOXIDE | ASTRAZENECA AB (SE) | 2010-10-14 | — | — | WO | disclosed |