Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | DPP4 | P27487 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10505523 | 0.81 | DPP4 (0.43) | KEAP1SMN1; SMN2KDM4EALDH1A1USP2 | |
| SCHEMBL646006 | 0.81 | KEAP1 (0.39) | KEAP1SMN1; SMN2KDM4EALDH1A1USP2 | |
| SCHEMBL6698493 | 0.80 | USP2 (0.48) | KEAP1SMN1; SMN2KDM4EALDH1A1USP2 | |
| SCHEMBL10506181 | 0.78 | KEAP1 (0.54) | KEAP1SMN1; SMN2KDM4EALDH1A1USP2 | |
| SCHEMBL9729323 | 0.74 | USP2 (0.52) | KEAP1SMN1; SMN2KDM4EALDH1A1USP2 | |
| SCHEMBL7177989 | 0.74 | DPP4 (0.39) | KEAP1SMN1; SMN2ALDH1A1USP2DPP4 | |
| SCHEMBL10913328 | 0.73 | KDM4E (0.70) | KEAP1SMN1; SMN2KDM4EALDH1A1USP2 | |
| SCHEMBL7326846 | 0.73 | KCNA5 (0.40) | KEAP1SMN1; SMN2ALDH1A1DPP4HPGD | |
| SCHEMBL4796080 | 0.73 | KEAP1 (0.52) | KEAP1SMN1; SMN2KDM4EALDH1A1USP2 | |
| SCHEMBL11708888 | 0.72 | USP2 (0.48) | KEAP1SMN1; SMN2KDM4EALDH1A1USP2 |
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-1931661-A1 | ISOXAZOLO DERIVATIVES AS GABA A ALPHA5 INVERSE AGONISTS | F.HOFFMANN-LA ROCHE AG (CH) | 2008-06-18 | — | — | EP | disclosed |
| WO-2007039389-A1 | ISOXAZOLO DERIVATIVES AS GABA A ALPHA5 INVERSE AGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2007-04-12 | — | — | WO | disclosed |