Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 7/20 | 0.36 |
| ▸ | CTSD | P07339 | 5/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.36 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA7 | P43166 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2281468 | 0.84 | BACE1 (0.47) | BACE1CTSDPTGS2AKR1C3AKR1C2 | |
| SCHEMBL2281465 | 0.84 | BACE1 (0.47) | BACE1CTSDPTGS2AKR1C3AKR1C2 | |
| SCHEMBL3393576 | 0.83 | BACE1 (0.44) | BACE1CTSDTAAR1 | |
| SCHEMBL3398703 | 0.81 | BACE1 (0.41) | BACE1CTSDTAAR1 | |
| SCHEMBL3398692 | 0.78 | BACE1 (0.46) | BACE1CTSDTAAR1 | |
| SCHEMBL3399266 | 0.77 | BACE1 (0.39) | BACE1CTSDTAAR1 | |
| SCHEMBL3399127 | 0.76 | BACE1 (0.54) | BACE1CTSDTAAR1 | |
| SCHEMBL3398471 | 0.73 | BACE1 (0.43) | BACE1CTSDTAAR1 | |
| SCHEMBL2280385 | 0.72 | PTGS2 (0.56) | PTGS2AKR1C3AKR1C2CA12CA1 | |
| SCHEMBL2282065 | 0.72 | BACE1 (0.52) | BACE1CTSDTAAR1 |
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 |