Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.66 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.66 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.66 |
| ▸ | HPGD | P15428 | 1/20 | 0.66 |
| ▸ | APEX1 | P27695 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 4/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.49 |
| ▸ | POLB | P06746 | 3/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | TP53 | P04637 | 2/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
| ▸ | CA6 | P23280 | 1/20 | 0.48 |
| ▸ | CA9 | Q16790 | 1/20 | 0.48 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | GAA | P10253 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL659462 | 0.96 | HSD17B10 (0.70) | HSD17B10CYP1A2CYP2C9HPGDAPEX1 | |
| SCHEMBL29664414 | 0.96 | HSD17B10 (0.70) | HSD17B10CYP1A2CYP2C9HPGDAPEX1 | |
| SCHEMBL24732325 | 0.85 | KMO (0.61) | HSD17B10CYP1A2CYP2C9HPGDAPEX1 | |
| SCHEMBL19779298 | 0.82 | CYP1A2 (0.47) | HSD17B10CYP1A2CYP2C9HPGDAPEX1 | |
| SCHEMBL27953642 | 0.82 | ATM (0.52) | HSD17B10CYP1A2CYP2C9HPGDAPEX1 | |
| SCHEMBL22482430 | 0.81 | L3MBTL1 (0.63) | HSD17B10CYP1A2CYP2C9HPGDMEN1 | |
| SCHEMBL571165 | 0.80 | MEN1 (0.51) | HSD17B10CYP1A2CYP2C9HPGDMEN1 | |
| SCHEMBL69064 | 0.79 | CYP1A2 (1.00) | HSD17B10CYP1A2CYP2C9HPGDAPEX1 | |
| SCHEMBL29380400 | 0.79 | CYP1A2 (1.00) | HSD17B10CYP1A2CYP2C9HPGDAPEX1 | |
| SCHEMBL2406839 | 0.79 | CYP1A2 (0.76) | HSD17B10CYP1A2CYP2C9HPGDAPEX1 |
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-1529045-A2 | NEW COMPOUNDS | Astra Zeneca AB (SE) | 2005-05-11 | — | — | EP | disclosed |
| WO-2004014881-A2 | '1,2,4'OXADIAZOLES AS MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR-5 | ASTRA ZENECA AB (SE) | 2004-02-19 | — | — | WO | disclosed |