Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | F10 | P00742 | 18/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL9930084 | 0.92 | KCNH2 (0.43) | KCNH2F10MAOAMAOBCYP2C19 | |
| SCHEMBL9930468 | 0.84 | — | — | |
| SCHEMBL4555333 | 0.82 | MAOA (0.38) | KCNH2F10MAOAMAOBCYP2C19 | |
| SCHEMBL9930612 | 0.81 | MAOA (0.34) | KCNH2MAOAMAOB | |
| SCHEMBL9964815 | 0.76 | KCNH2 (0.46) | KCNH2F10MAOAMAOBCYP2C19 | |
| SCHEMBL4555076 | 0.74 | MAOA (0.47) | KCNH2F10MAOAMAOBCYP2C19 | |
| SCHEMBL9929840 | 0.74 | MAOA (0.46) | KCNH2F10MAOAMAOBCYP2C19 | |
| SCHEMBL9930383 | 0.72 | KCNH2 (0.42) | KCNH2F10MAOAMAOBCYP2C19 | |
| SCHEMBL9930417 | 0.70 | MAOA (0.42) | KCNH2F10MAOAMAOBCYP2C19 | |
| SCHEMBL9930581 | 0.70 | NAMPT (0.44) | KCNH2F10MAOAMAOBCYP2C19 |
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 |