Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.39 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.37 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.36 |
| ▸ | PPARG | P37231 | 2/20 | 0.36 |
| ▸ | PPARA | Q07869 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | MITF | O75030 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | GHSR | Q92847 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL198628 | 0.88 | NR1H4 (0.38) | — | |
| SCHEMBL1841448 | 0.88 | PTGDR2 (0.38) | PTGDR2PTGDRMAP4K4MEN1KMT2A | |
| SCHEMBL198388 | 0.86 | PPARA (0.42) | SMN1; SMN2MAP4K4PPARGPPARAMEN1 | |
| SCHEMBL1842508 | 0.85 | GLA (0.43) | SMN1; SMN2PTGDR2PTGDRMEN1KMT2A | |
| SCHEMBL1839302 | 0.85 | NR1H4 (0.43) | MAP4K4PPARGPPARATP53LMNA | |
| SCHEMBL1840368 | 0.84 | NR1H4 (0.33) | PTGDR2TP53LMNA | |
| SCHEMBL1837083 | 0.84 | GAA (0.39) | SMN1; SMN2NPSR1KMT2ATP53LMNA | |
| SCHEMBL1840289 | 0.84 | CYP2C9 (0.41) | MAP4K4PPARGPPARATP53LMNA | |
| SCHEMBL1842591 | 0.84 | NR1H4 (0.34) | SMN1; SMN2NPSR1MEN1KMT2ATP53 | |
| SCHEMBL1837672 | 0.83 | NR1H4 (0.40) | SMN1; SMN2KMT2AALDH1A1THRB |
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-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 |