Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 18/20 | 0.50 |
| ▸ | MAOA | P21397 | 2/20 | 0.43 |
| ▸ | MAOB | P27338 | 2/20 | 0.43 |
| ▸ | BCHE | P06276 | 1/20 | 0.43 |
| ▸ | KDM1A | O60341 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3301612 | 0.89 | ACHE (0.52) | ACHEMAOAMAOBBCHE | |
| SCHEMBL3301607 | 0.89 | ACHE (0.52) | ACHEMAOAMAOBBCHE | |
| SCHEMBL14371529 | 0.87 | ACHE (0.68) | ACHEMAOAMAOBBCHE | |
| SCHEMBL20528015 | 0.85 | ACHE (0.44) | ACHEMAOAMAOBBCHEKDM1A | |
| SCHEMBL3298369 | 0.85 | ACHE (0.47) | ACHEMAOAMAOBBCHEKDM1A | |
| SCHEMBL14371530 | 0.84 | ACHE (0.70) | ACHEMAOAMAOBBCHE | |
| SCHEMBL484634 | 0.83 | PDE4A (0.45) | ACHE | |
| SCHEMBL784858 | 0.83 | PDE4A (0.45) | ACHE | |
| SCHEMBL17702025 | 0.83 | NQO2 (0.53) | ACHEMAOAMAOBBCHE | |
| SCHEMBL3300984 | 0.83 | MAOA (0.50) | ACHEMAOAMAOB |
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-2619178-A1 | SUBSTITUTED BENZAMIDE COMPOUNDS | Grünenthal GmbH (DE) | 2013-07-31 | — | — | EP | disclosed |
| WO-2012038081-A1 | SUBSTITUTED BENZAMIDE COMPOUNDS | Grünenthal GmbH (DE) | 2012-03-29 | — | — | WO | disclosed |