Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 5/20 | 0.40 |
| ▸ | PPARG | P37231 | 2/20 | 0.40 |
| ▸ | PPARD | Q03181 | 1/20 | 0.38 |
| ▸ | BCL9 | O00512 | 10/20 | 0.38 |
| ▸ | CTNNB1 | P35222 | 10/20 | 0.38 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.34 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | FABP2 | P12104 | 1/20 | 0.33 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.33 |
| ▸ | PDE5A | O76074 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL198388 | 0.93 | PPARA (0.42) | PPARAPPARGPPARDMAP4K4MEN1 | |
| SCHEMBL1839730 | 0.91 | PPARA (0.41) | PPARAPPARGBCL9CTNNB1CYP1A2 | |
| SCHEMBL1843200 | 0.90 | PPARA (0.37) | PPARAPPARGPPARDBCL9CTNNB1 | |
| SCHEMBL198480 | 0.87 | PPARA (0.36) | PPARAPPARGPPARDMAP4K4MEN1 | |
| SCHEMBL1839001 | 0.86 | NR4A2 (0.42) | PPARG | |
| SCHEMBL1841851 | 0.86 | PTGDR2 (0.33) | PPARAPPARGPPARDMEN1CYP1A2 | |
| SCHEMBL1842335 | 0.83 | PPARA (0.47) | PPARAPPARGMEN1CYP1A2CYP3A4 | |
| SCHEMBL1838536 | 0.82 | SMN1; SMN2 (0.38) | MAPT | |
| SCHEMBL1841448 | 0.81 | PTGDR2 (0.38) | MAP4K4MEN1MAPTKMT2A | |
| SCHEMBL1840368 | 0.81 | NR1H4 (0.33) | CYP3A4CYP2D6MAPTKCNH2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2321282-A1 | NEW BENZIMIDAZOLE DERIVATIVES | F. Hoffmann-La Roche AG (CH) | 2011-05-18 | — | — | EP | claimed |
| WO-2010028981-A1 | NEW BENZIMIDAZOLE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2010-03-18 | — | — | WO | claimed |
| EP-2321282-A1 | NEW BENZIMIDAZOLE DERIVATIVES | F. Hoffmann-La Roche AG (CH) | 2011-05-18 | — | — | EP | disclosed |
| WO-2010028981-A1 | NEW BENZIMIDAZOLE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2010-03-18 | — | — | WO | disclosed |