Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 4/20 | 0.40 |
| ▸ | SLC2A1 | P11166 | 5/20 | 0.36 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.30 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.30 |
| ▸ | SLC6A3 | Q01959 | 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 | |
|---|---|---|---|---|
| SCHEMBL5267103 | 0.89 | KCNH2 (0.37) | KCNH2SLC2A1MEN1KMT2ASLC6A2 | |
| SCHEMBL5262148 | 0.81 | KCNH2 (0.59) | KCNH2SLC2A1 | |
| SCHEMBL5436003 | 0.81 | KCNH2 (0.48) | KCNH2SLC2A1 | |
| SCHEMBL5435565 | 0.81 | KCNH2 (0.40) | KCNH2SLC2A1CD274 | |
| SCHEMBL5264505 | 0.78 | IRAK1 (0.42) | KCNH2SLC2A1PDCD1CD274 | |
| SCHEMBL5433288 | 0.76 | KCNH2 (0.48) | KCNH2 | |
| SCHEMBL5436108 | 0.76 | — | — | |
| SCHEMBL5432559 | 0.76 | SLC2A1 (0.35) | KCNH2SLC2A1 | |
| SCHEMBL5437133 | 0.76 | HTR1A (0.44) | KCNH2SLC6A4 | |
| SCHEMBL5436007 | 0.76 | KCNH2 (0.34) | KCNH2SLC2A1 |
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-1781650-A1 | NOVEL COMPOUNDS HAVING AN ANTI-BACTERIAL ACTIVITY | Morphochem Aktiengesellschaft Für Kombinatorische Chemie (DE) | 2007-05-09 | — | — | EP | disclosed |
| WO-2006021448-A1 | NOVEL COMPOUNDS HAVING AN ANTI-BACTERIAL ACTIVITY | Morphochem Aktiengesellschaft für kombinatorische Chemie (DE) | 2006-03-02 | — | — | WO | disclosed |