Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | KDM1A | O60341 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL15693450 | 0.87 | TAAR1 (0.41) | TAAR1CYP2D6KDM1AL3MBTL1 | |
| Etoxazole SCHEMBL27300 | 0.84 | TAAR1 (0.36) | TAAR1CYP2D6KDM1A | |
| Etoxazole SCHEMBL29763628 | 0.84 | TAAR1 (0.36) | TAAR1CYP2D6KDM1A | |
| Etoxazole SCHEMBL29376426 | 0.84 | TAAR1 (0.36) | TAAR1CYP2D6KDM1A | |
| SCHEMBL7515974 | 0.84 | TAAR1 (0.36) | TAAR1CYP2D6L3MBTL1 | |
| SCHEMBL16116997 | 0.84 | TAAR1 (0.36) | TAAR1CYP2D6KDM1A | |
| SCHEMBL8655063 | 0.82 | TAAR1 (0.34) | TAAR1CYP2D6KDM1A | |
| SCHEMBL8658764 | 0.79 | TAAR1 (0.32) | TAAR1CYP2D6 | |
| SCHEMBL9306512 | 0.78 | TAAR1 (0.44) | TAAR1CYP2D6 | |
| SCHEMBL7130839 | 0.77 | SCN9A (0.36) | — |
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-0871634-A1 | ARTHROPODICIDAL OXAZOLINES AND THIAZOLINES | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1998-10-21 | — | — | EP | disclosed |
| WO-1997013773-A1 | ARTHROPODICIDAL OXAZOLINES AND THIAZOLINES | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1997-04-17 | — | — | WO | disclosed |