Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRAF | P15056 | 5/20 | 0.36 |
| ▸ | PTGES2 | Q9H7Z7 | 7/20 | 0.35 |
| ▸ | WDR5 | P61964 | 2/20 | 0.34 |
| ▸ | SCN7A | Q01118 | 1/20 | 0.33 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.33 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.32 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.32 |
| ▸ | EGFR | P00533 | 1/20 | 0.32 |
| ▸ | KRAS | P01116 | 1/20 | 0.32 |
| ▸ | RAF1 | P04049 | 1/20 | 0.32 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
| ▸ | RET | P07949 | 1/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.32 |
| ▸ | ARAF | P10398 | 1/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.32 |
| ▸ | FECH | P22830 | 1/20 | 0.32 |
| ▸ | KDR | P35968 | 1/20 | 0.32 |
| ▸ | MAP2K2 | P36507 | 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 | |
|---|---|---|---|---|
| SCHEMBL6121823 | 0.94 | CYP3A4 (0.36) | BRAFPTGES2WDR5CYP2C19CYP3A4 | |
| SCHEMBL6121078 | 0.93 | PTGES2 (0.35) | BRAFPTGES2WDR5 | |
| SCHEMBL6120989 | 0.92 | BRAF (0.34) | BRAFPTGES2WDR5CYP2C19CYP3A4 | |
| SCHEMBL6120670 | 0.92 | PTGES2 (0.37) | BRAFPTGES2WDR5SCN7ASCN5A | |
| SCHEMBL6121300 | 0.91 | PTGES2 (0.38) | BRAFPTGES2EGFR | |
| SCHEMBL6120967 | 0.90 | WDR5 (0.36) | BRAFPTGES2WDR5CYP2C19CYP3A4 | |
| SCHEMBL6120931 | 0.90 | BRAF (0.35) | BRAFPTGES2SCN7ASCN5ARIPK2 | |
| SCHEMBL6120639 | 0.89 | WDR5 (0.37) | BRAFPTGES2WDR5RIPK2ABCB11 | |
| SCHEMBL6120536 | 0.88 | BRAF (0.38) | BRAFWDR5CHRM1 | |
| SCHEMBL6120643 | 0.88 | BRAF (0.34) | BRAFPTGES2WDR5CYP2C19CYP3A4 |
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-2012067664-A1 | COMPOUNDS | GLAXO GROUP LIMITED (GB) | 2012-05-24 | — | — | WO | disclosed |