Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 2/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9930066 | 1.00 | MAOA (0.36) | MAOAMAOBKCNH2CYP3A4CYP2D6 | |
| SCHEMBL9964807 | 0.90 | MAOA (0.37) | MAOAMAOBKCNH2CYP3A4CYP2D6 | |
| SCHEMBL4555055 | 0.88 | MAOA (0.36) | MAOAMAOBKCNH2 | |
| SCHEMBL9930461 | 0.87 | MAOA (0.35) | MAOAMAOBKCNH2 | |
| SCHEMBL14069236 | 0.82 | MAOA (0.41) | MAOAMAOBKCNH2CYP3A4CYP2D6 | |
| SCHEMBL9930479 | 0.81 | MAOA (0.40) | MAOAMAOBKCNH2CYP3A4CYP2D6 | |
| SCHEMBL9930178 | 0.78 | MAOA (0.35) | MAOAMAOBKCNH2CYP3A4CYP2D6 | |
| SCHEMBL9930034 | 0.76 | MAOA (0.51) | MAOAMAOBKCNH2 | |
| SCHEMBL9964804 | 0.76 | MAOA (0.47) | MAOAMAOBKCNH2CYP3A4CYP2D6 | |
| SCHEMBL9930190 | 0.76 | CYP3A4 (0.46) | MAOAMAOBCYP3A4CYP2D6 |
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-2134721-A1 | ANTIMICROBIAL HETEROCYCLIC COMPOUNDS FOR TREATMENT OF BACTERIAL INFECTIONS | Micurx Pharmaceuticals, Inc. (US) | 2009-12-23 | — | — | EP | disclosed |
| WO-2008108988-A1 | ANTIMICROBIAL HETEROCYCLIC COMPOUNDS FOR TREATMENT OF BACTERIAL INFECTIONS | MICURX PHARMACEUTICALS, INC. (US) | 2008-09-12 | — | — | WO | disclosed |