Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | NR1H4 | Q96RI1 | 6/20 | 0.33 |
| ▸ | REN | P00797 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 3/20 | 0.32 |
| ▸ | MDM4 | O15151 | 2/20 | 0.32 |
| ▸ | MDM2 | Q00987 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 3/20 | 0.31 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.31 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.30 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL1838923 | 0.92 | NR1H4 (0.40) | LMNAHPGDSMN1; SMN2NR1H4TP53 | |
| SCHEMBL1839912 | 0.88 | NR1H4 (0.33) | LMNASMN1; SMN2NR1H4RENTP53 | |
| SCHEMBL1843050 | 0.88 | NR1H4 (0.33) | LMNASMN1; SMN2NR1H4RENTP53 | |
| SCHEMBL1841282 | 0.88 | GABRA5 (0.36) | LMNAHPGDSMN1; SMN2NR1H4 | |
| SCHEMBL1840349 | 0.85 | NR1H4 (0.40) | LMNAHPGDSMN1; SMN2NR1H4REN | |
| SCHEMBL1842553 | 0.83 | MDM2 (0.33) | SMN1; SMN2NR1H4MDM2MAPTPTGDR | |
| SCHEMBL1840602 | 0.83 | NR1H4 (0.36) | NR1H4 | |
| SCHEMBL1840286 | 0.81 | NR1H4 (0.40) | NR1H4MAPTCYP2C9KCNH2CYP3A4 | |
| SCHEMBL1840258 | 0.80 | NR1H4 (0.36) | NR1H4 | |
| SCHEMBL1838551 | 0.80 | CHEK1 (0.33) | LMNAHPGDSMN1; SMN2NR1H4TP53 |
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 |