Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | CTSK | P43235 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.31 |
| ▸ | ATF4 | P18848 | 3/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
| ▸ | REN | P00797 | 1/20 | 0.30 |
| ▸ | CTSD | P07339 | 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 | |
|---|---|---|---|---|
| SCHEMBL1839302 | 0.91 | NR1H4 (0.43) | CYP2C9NR1H4TP53LMNAALDH1A1 | |
| SCHEMBL1839895 | 0.91 | NR1H4 (0.36) | CYP2C9NR1H4CTSKSLC6A4HTR2A | |
| SCHEMBL1842633 | 0.91 | CYP2C9 (0.35) | CYP2C9NR1H4TP53LMNAALDH1A1 | |
| SCHEMBL1840289 | 0.90 | CYP2C9 (0.41) | CYP2C9NR1H4TP53LMNAALDH1A1 | |
| SCHEMBL1842508 | 0.87 | GLA (0.43) | TP53LMNAALDH1A1ATF4 | |
| SCHEMBL1841448 | 0.84 | PTGDR2 (0.38) | ATF4MAPT | |
| SCHEMBL198628 | 0.84 | NR1H4 (0.38) | CYP2C9NR1H4 | |
| SCHEMBL1838591 | 0.83 | LMNA (0.32) | CYP2C9NR1H4TP53LMNASLC6A3 | |
| SCHEMBL1840672 | 0.83 | SMN1; SMN2 (0.40) | TP53LMNAALDH1A1THRBHTR2A | |
| SCHEMBL1841265 | 0.82 | BACE1 (0.36) | NR1H4 |
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 |