Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PYGB | P11216 | 2/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | TLR4 | O00206 | 6/20 | 0.48 |
| ▸ | LY96 | Q9Y6Y9 | 6/20 | 0.47 |
| ▸ | TRPV1 | Q8NER1 | 4/20 | 0.47 |
| ▸ | CNR1 | P21554 | 2/20 | 0.47 |
| ▸ | CNR2 | P34972 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL10816130 | 1.00 | PYGB (0.52) | PYGBMAPK1KDM4ELMNACYP2D6 | |
| SCHEMBL13321928 | 1.00 | PYGB (0.52) | PYGBMAPK1KDM4ELMNACYP2D6 | |
| SCHEMBL13321930 | 1.00 | PYGB (0.52) | PYGBMAPK1KDM4ELMNACYP2D6 | |
| SCHEMBL31472776 | 1.00 | PYGB (0.52) | PYGBMAPK1KDM4ELMNACYP2D6 | |
| SCHEMBL15504507 | 1.00 | PYGB (0.52) | PYGBMAPK1KDM4ELMNACYP2D6 | |
| SCHEMBL10602999 | 1.00 | PYGB (0.52) | PYGBMAPK1KDM4ELMNACYP2D6 | |
| SCHEMBL31680313 | 1.00 | PYGB (0.52) | PYGBMAPK1KDM4ELMNACYP2D6 | |
| SCHEMBL5158758 | 0.99 | PYGB (0.54) | PYGBMAPK1KDM4ELMNACYP2D6 | |
| SCHEMBL5158751 | 0.99 | PYGB (0.54) | PYGBMAPK1KDM4ELMNACYP2D6 | |
| SCHEMBL5157881 | 0.94 | PYGB (0.55) | PYGBMAPK1KDM4ELMNACYP2D6 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012036838-A2 | SUBSTITUTED SACCHARIDE COMPOUNDS AND DENTAL COMPOSITIONS | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2012-03-22 | — | — | WO | disclosed |