Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.52 |
| ▸ | MAOB | P27338 | 2/20 | 0.52 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.52 |
| ▸ | AOC2 | O75106 | 1/20 | 0.52 |
| ▸ | MAOA | P21397 | 1/20 | 0.52 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.46 |
| ▸ | PLA2G1B | P04054 | 2/20 | 0.45 |
| ▸ | ATG4B | Q9Y4P1 | 2/20 | 0.45 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.44 |
| ▸ | IDO1 | P14902 | 2/20 | 0.44 |
| ▸ | SLC5A1 | P13866 | 1/20 | 0.43 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6895380 | 0.81 | PTGS1 (0.43) | TAAR1MAOBAOC3AOC2MAOA | |
| SCHEMBL11260863 | 0.80 | FFAR1 (0.52) | TAAR1MAOBAOC3AOC2MAOA | |
| SCHEMBL4843038 | 0.78 | IDO1 (0.53) | TAAR1MAOBAOC3AOC2MAOA | |
| SCHEMBL13349456 | 0.78 | TAAR1 (0.52) | TAAR1MAOBAOC3AOC2MAOA | |
| SCHEMBL2466699 | 0.78 | FFAR1 (0.55) | TAAR1MAOBAOC3AOC2MAOA | |
| SCHEMBL6894446 | 0.78 | IDO1 (0.58) | TAAR1MAOBAOC3FFAR1IDO1 | |
| SCHEMBL18003011 | 0.78 | TAAR1 (0.57) | TAAR1MAOBFFAR1IDO1 | |
| SCHEMBL6895007 | 0.77 | PLA2G1B (0.48) | TAAR1PLA2G1BATG4BLOXL2IDO1 | |
| SCHEMBL3651336 | 0.77 | KEAP1 (0.54) | TAAR1MAOBMAOAFFAR1LOXL2 | |
| Hydrochloric Acid SCHEMBL4714243 | 0.77 | IDO1 (0.55) | TAAR1MAOBAOC3AOC2MAOA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1126833-A4 | OXADIAZOLE, THIADIAZOLE AND TRIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF | TREGA BIOSCIENCES INC (US) | 2004-09-08 | — | — | EP | claimed |
| EP-1126833-A2 | OXADIAZOLE, THIADIAZOLE AND TRIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF | TREGA BIOSCIENCES, INC. (US) | 2001-08-29 | — | — | EP | claimed |
| WO-2000025768-A1 | OXADIAZOLE, THIADIAZOLE AND TRIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF | TREGA BIOSCIENCES, INC. (US) | 2000-05-11 | — | — | WO | claimed |