Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 5/20 | 0.49 |
| ▸ | PTGER1 | P34995 | 2/20 | 0.34 |
| ▸ | SCN4A | P35499 | 2/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.32 |
| ▸ | CCR1 | P32246 | 1/20 | 0.31 |
| ▸ | AGER | Q15109 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | CNR1 | P21554 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 1/20 | 0.31 |
| ▸ | TAOK1 | Q7L7X3 | 1/20 | 0.31 |
| ▸ | TAOK3 | Q9H2K8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1840285 | 0.91 | NR1H4 (0.41) | NR1H4S1PR1LMNAHPGDSMN1; SMN2 | |
| SCHEMBL1841925 | 0.91 | NR1H4 (0.47) | NR1H4PTGER1S1PR1CYP2C9KCNH2 | |
| SCHEMBL1838224 | 0.89 | NR1H4 (0.38) | NR1H4PTGER1CYP2C9KCNH2MRGPRX4 | |
| SCHEMBL1839771 | 0.87 | NR1H4 (0.37) | NR1H4CYP2C9KCNH2HPGD | |
| SCHEMBL1842245 | 0.85 | NR4A2 (0.40) | LMNASMN1; SMN2MRGPRX4 | |
| SCHEMBL1841980 | 0.85 | NR1H4 (0.34) | NR1H4SCN4AS1PR1 | |
| SCHEMBL1842341 | 0.83 | NR1H4 (0.39) | NR1H4CYP2C9KCNH2LMNATP53 | |
| SCHEMBL1839064 | 0.83 | NR1H4 (0.39) | NR1H4CYP2C9KCNH2LMNATP53 | |
| SCHEMBL1840349 | 0.83 | NR1H4 (0.40) | NR1H4S1PR1CYP2C9KCNH2LMNA | |
| SCHEMBL1840484 | 0.82 | MRGPRX4 (0.39) | NR1H4PTGER1CYP2C9KCNH2LMNA |
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 |