Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2E1 | P05181 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 2/20 | 0.38 |
| ▸ | MIF | P14174 | 15/20 | 0.38 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.34 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5654967 | 0.89 | MIF (0.39) | CYP2E1MAOAMIFMAOB | |
| SCHEMBL5654974 | 0.89 | MIF (0.39) | CYP2E1MAOAMIFMAOB | |
| SCHEMBL5654348 | 0.85 | PDE3B (0.42) | CYP2E1MAOAMIFPDE3BPDE3A | |
| SCHEMBL5654353 | 0.85 | PDE3B (0.42) | CYP2E1MAOAMIFPDE3BPDE3A | |
| SCHEMBL5655995 | 0.84 | MIF (0.40) | CYP2E1MAOAMIFPDE3BPDE3A | |
| SCHEMBL5656000 | 0.84 | MIF (0.40) | CYP2E1MAOAMIFPDE3BPDE3A | |
| SCHEMBL5654102 | 0.84 | MIF (0.39) | CYP2E1MAOAMIFPDE3BPDE3A | |
| SCHEMBL5654108 | 0.84 | MIF (0.39) | CYP2E1MAOAMIFPDE3BPDE3A | |
| SCHEMBL5656828 | 0.83 | KDR (0.45) | CYP2E1MAOAMIFMAOB | |
| SCHEMBL5655616 | 0.82 | MIF (0.38) | CYP2E1MAOAMIFPDE3BPDE3A |
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-1242416-A1 | SUBSTITUTED ISOXAZOLINES AND THEIR USE AS ANTIBACTERIAL AGENTS | AstraZeneca AB (SE) | 2002-09-25 | — | — | EP | claimed |
| WO-2001040222-A1 | SUBSTITUTED ISOXAZOLINES AND THEIR USE AS ANTIBACTERIAL AGENTS | ASTRAZENECA AB (SE) | 2001-06-07 | — | — | WO | claimed |