Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.65 |
| ▸ | MTOR | P42345 | 2/20 | 0.65 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.63 |
| ▸ | VCP | P55072 | 1/20 | 0.53 |
| ▸ | NQO2 | P16083 | 2/20 | 0.52 |
| ▸ | LCK | P06239 | 1/20 | 0.52 |
| ▸ | MAOB | P27338 | 6/20 | 0.50 |
| ▸ | MAOA | P21397 | 5/20 | 0.50 |
| ▸ | APP | P05067 | 4/20 | 0.50 |
| ▸ | CA12 | O43570 | 2/20 | 0.50 |
| ▸ | CA1 | P00915 | 2/20 | 0.50 |
| ▸ | CA2 | P00918 | 2/20 | 0.50 |
| ▸ | CA3 | P07451 | 2/20 | 0.50 |
| ▸ | CA4 | P22748 | 2/20 | 0.50 |
| ▸ | CA6 | P23280 | 2/20 | 0.50 |
| ▸ | CA5A | P35218 | 2/20 | 0.50 |
| ▸ | CA7 | P43166 | 2/20 | 0.50 |
| ▸ | CA9 | Q16790 | 2/20 | 0.50 |
| ▸ | CA13 | Q8N1Q1 | 2/20 | 0.50 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL28785073 | 0.82 | NFE2L2 (0.64) | NPC1MTORTRPA1NQO2LCK | |
| SCHEMBL25202875 | 0.81 | CTSL (0.65) | MAOBMAOAMEN1CYP3A4MAPT | |
| SCHEMBL30382939 | 0.81 | CTSL (0.65) | MAOBMAOAMEN1CYP3A4MAPT | |
| SCHEMBL25218023 | 0.81 | CTSL (0.65) | MAOBMAOAMEN1CYP3A4MAPT | |
| SCHEMBL30383863 | 0.81 | CTSL (0.65) | MAOBMAOAMEN1CYP3A4MAPT | |
| SCHEMBL6374804 | 0.78 | NPC1 (1.00) | NPC1MTORTRPA1NQO2LCK | |
| SCHEMBL15093091 | 0.78 | NPC1 (1.00) | NPC1MTORTRPA1NQO2LCK | |
| SCHEMBL29819435 | 0.78 | NPC1 (1.00) | NPC1MTORTRPA1NQO2LCK | |
| SCHEMBL15093090 | 0.78 | NPC1 (1.00) | NPC1MTORTRPA1NQO2LCK | |
| SCHEMBL38650704 | 0.78 | VCP (0.58) | NPC1MTORTRPA1VCPMAOB |
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 |