Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 9/20 | 0.55 |
| ▸ | CYP1A1 | P04798 | 3/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.50 |
| ▸ | CYP1B1 | Q16678 | 3/20 | 0.50 |
| ▸ | NQO2 | P16083 | 1/20 | 0.50 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.49 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.49 |
| ▸ | TUBB1 | Q9H4B7 | 4/20 | 0.46 |
| ▸ | RELA | Q04206 | 1/20 | 0.46 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.44 |
| ▸ | TUBB | P07437 | 1/20 | 0.44 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.44 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.44 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.44 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.44 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.44 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.44 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.44 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.44 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL3393529 | 0.82 | HSD17B3 (0.41) | APPNQO2PTGS1NFE2L2RELA | |
| SCHEMBL3395891 | 0.81 | TUBB1 (0.64) | APPCYP1A1CYP1A2CYP1B1NQO2 | |
| SCHEMBL5491895 | 0.77 | RELA (0.71) | APPCYP1A1CYP1A2CYP1B1NQO2 | |
| SCHEMBL5491899 | 0.77 | RELA (0.71) | APPCYP1A1CYP1A2CYP1B1NQO2 | |
| SCHEMBL15938427 | 0.76 | TYR (0.58) | CYP1A1CYP1A2CYP1B1NFE2L2TUBB1 | |
| SCHEMBL15938428 | 0.76 | TYR (0.58) | CYP1A1CYP1A2CYP1B1NFE2L2TUBB1 | |
| SCHEMBL3362009 | 0.76 | NQO2 (0.72) | CYP1A1CYP1A2CYP1B1NQO2PTGS1 | |
| SCHEMBL3360764 | 0.76 | NQO2 (0.72) | CYP1A1CYP1A2CYP1B1NQO2PTGS1 | |
| SCHEMBL858370 | 0.75 | ALDH1A1 (0.51) | — | |
| SCHEMBL30424732 | 0.75 | ALDH1A1 (0.51) | — |
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 |