Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 6/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.32 |
| ▸ | REN | P00797 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.32 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.31 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.31 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | EPHX1 | P07099 | 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 | |
|---|---|---|---|---|
| SCHEMBL1843050 | 1.00 | NR1H4 (0.33) | NR1H4KMT2AMAPTLMNATP53 | |
| SCHEMBL1842553 | 0.94 | MDM2 (0.33) | NR1H4KMT2AMAPTGAASMN1; SMN2 | |
| SCHEMBL1840349 | 0.93 | NR1H4 (0.40) | NR1H4KMT2AMAPTLMNATP53 | |
| SCHEMBL1839064 | 0.90 | NR1H4 (0.39) | NR1H4KMT2AMAPTLMNATP53 | |
| SCHEMBL1842341 | 0.90 | NR1H4 (0.39) | NR1H4KMT2AMAPTLMNATP53 | |
| SCHEMBL1840310 | 0.90 | NR1H4 (0.36) | NR1H4KMT2AMAPTCYP3A4CYP2D6 | |
| SCHEMBL1844170 | 0.88 | LMNA (0.35) | NR1H4KMT2AMAPTLMNATP53 | |
| SCHEMBL1841033 | 0.88 | KDM4E (0.36) | NR1H4KMT2ACNR1CYP3A4CYP2D6 | |
| SCHEMBL1842692 | 0.87 | NPC1 (0.37) | NR1H4KMT2AMAPTLMNATP53 | |
| SCHEMBL1838564 | 0.87 | SMN1; SMN2 (0.38) | NR1H4KMT2AMAPTLMNAGAA |
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 |