Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 1/20 | 0.49 |
| ▸ | RELA | Q04206 | 4/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.41 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.41 |
| ▸ | APP | P05067 | 1/20 | 0.41 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 2/20 | 0.40 |
| ▸ | CA1 | P00915 | 2/20 | 0.40 |
| ▸ | CA9 | Q16790 | 2/20 | 0.40 |
| ▸ | BACE1 | P56817 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.38 |
| ▸ | KDR | P35968 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6158612 | 0.90 | HSP90AA1 (0.50) | CHRNA7RELAHSP90AA1HSP90AB1NFE2L2 | |
| SCHEMBL9699570 | 0.84 | TRPA1 (0.53) | CHRNA7RELAHSP90AA1HSP90AB1CA12 | |
| SCHEMBL8647804 | 0.84 | CA12 (0.42) | CHRNA7RELACA12CA1CA9 | |
| SCHEMBL8647806 | 0.84 | CA12 (0.42) | CHRNA7RELACA12CA1CA9 | |
| SCHEMBL7189378 | 0.84 | CA12 (0.46) | RELANFE2L2CA12CA1CA9 | |
| SCHEMBL6156781 | 0.81 | CHRNA7 (0.43) | CHRNA7HSD17B3BACE1ALDH1A1MAOB | |
| SCHEMBL21356550 | 0.80 | ESR1 (0.50) | CA12CA1CA9CYP19A1 | |
| SCHEMBL3398279 | 0.78 | VCP (0.42) | RELANFE2L2CA12CA1CA9 | |
| SCHEMBL5491899 | 0.78 | RELA (0.71) | CHRNA7RELANFE2L2APPCYP19A1 | |
| SCHEMBL5491895 | 0.78 | RELA (0.71) | CHRNA7RELANFE2L2APPCYP19A1 |
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-2245019-A1 | 4, 5-DIHYDRO-OXAZOL-2-YL AMINE DERIVATIVES | F. Hoffmann-La Roche AG (CH) | 2010-11-03 | — | — | EP | disclosed |
| WO-2009103626-A1 | 4, 5-DIHYDRO-OXAZOL-2-YL AMINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2009-08-27 | — | — | WO | disclosed |