Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL1433091 | 0.89 | TDP1 (0.30) | L3MBTL1 | |
| SCHEMBL1432782 | 0.84 | ALDH1A1 (0.38) | ALDH1A1L3MBTL1 | |
| SCHEMBL1433330 | 0.79 | KMT2A (0.33) | ALDH1A1L3MBTL1CYP1A2 | |
| SCHEMBL335709 | 0.78 | PLAU (0.31) | L3MBTL1 | |
| SCHEMBL335579 | 0.77 | ALDH1A1 (0.36) | ALDH1A1L3MBTL1CYP1A2 | |
| SCHEMBL336024 | 0.74 | ALDH1A1 (0.41) | ALDH1A1L3MBTL1CYP1A2 | |
| SCHEMBL335600 | 0.68 | ALDH1A1 (0.41) | ALDH1A1L3MBTL1CYP1A2 | |
| SCHEMBL1433087 | 0.68 | ALDH1A1 (0.35) | ALDH1A1L3MBTL1 | |
| SCHEMBL14944013 | 0.65 | ALDH1A1 (0.41) | ALDH1A1L3MBTL1 | |
| SCHEMBL2494719 | 0.65 | DPP4 (0.32) | — |
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-2300476-A1 | TRICYCLIC NITROGEN CONTAINING COMPOUNDS AND THEIR USE AS ANTIBACTERIALS | Glaxo Group Limited (GB) | 2011-03-30 | — | — | EP | disclosed |
| WO-2009141398-A1 | TRICYCLIC NITROGEN CONTAINING COMPOUNDS AND THEIR USE AS ANTIBACTERIALS | GLAXO GROUP LIMITED (GB) | 2009-11-26 | — | — | WO | disclosed |