Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RPS6KA2 | Q15349 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.38 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.38 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | KRAS | P01116 | 1/20 | 0.36 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16606250 | 0.88 | MCHR1 (0.40) | RPS6KA2KMT2ANPSR1MCHR1IRAK4 | |
| SCHEMBL17912820 | 0.86 | NPSR1 (0.46) | NPSR1NFE2L2MCHR1IRAK4ALDH1A1 | |
| SCHEMBL1627720 | 0.81 | NFE2L2 (0.50) | KMT2ANFE2L2TDP1L3MBTL1ALDH1A1 | |
| SCHEMBL29669870 | 0.81 | NFE2L2 (0.50) | KMT2ANFE2L2TDP1L3MBTL1ALDH1A1 | |
| SCHEMBL2038072 | 0.80 | L3MBTL1 (0.45) | KMT2ANPSR1MCHR1IRAK4TDP1 | |
| SCHEMBL11916154 | 0.79 | SLC6A4 (0.40) | KMT2AMCHR1KCNN4KCNH2TMEM97 | |
| SCHEMBL16953349 | 0.78 | NPSR1 (0.41) | NPSR1MCHR1IRAK4KCNH2ALDH1A1 | |
| SCHEMBL12120829 | 0.78 | MCHR1 (0.39) | RPS6KA2KMT2ANPSR1MCHR1IRAK4 | |
| SCHEMBL19612192 | 0.78 | SMN1; SMN2 (0.47) | KMT2ANPSR1NFE2L2MCHR1IRAK4 | |
| SCHEMBL11916618 | 0.78 | SLC6A2 (0.43) | NPSR1MCHR1IRAK4KCNN4ALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011064789-A1 | IMPROVED PROCESS FOR THE PREPARATION OF HALO-DIALKOXYBENZENES | HIKAL LIMITED (IN) | 2011-06-03 | — | — | WO | disclosed |