Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORC | P51449 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 5/20 | 0.49 |
| ▸ | THRB | P10828 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.49 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.45 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.45 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.45 |
| ▸ | GRM5 | P41594 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL30302200 | 0.90 | NR1H2 (0.53) | RORCMAPTTHRBALDH1A1NPSR1 | |
| SCHEMBL12253466 | 0.90 | NR1H2 (0.56) | RORCMAPTTHRBALDH1A1NPSR1 | |
| SCHEMBL30302195 | 0.88 | RORC (0.47) | RORCMAPTALDH1A1NPSR1MCOLN3 | |
| SCHEMBL30302196 | 0.88 | SLC9A1 (0.47) | RORCMAPTTHRBALDH1A1NPSR1 | |
| SCHEMBL30302203 | 0.85 | NR1H2 (0.49) | RORCMAPTTHRBALDH1A1NPSR1 | |
| SCHEMBL30302192 | 0.85 | HTT (0.48) | RORCMAPTALDH1A1NPSR1MCOLN3 | |
| SCHEMBL30302188 | 0.83 | MAPT (0.47) | RORCMAPTALDH1A1NPSR1SLC9A1 | |
| SCHEMBL7011123 | 0.81 | SLC9A1 (0.54) | MAPTALDH1A1CYP2C19SLC9A1MEN1 | |
| SCHEMBL24329855 | 0.80 | SLC9A1 (0.44) | RORCMAPTSLC9A1MEN1KMT2A | |
| SCHEMBL30302187 | 0.80 | RORC (0.54) | RORCALDH1A1NPSR1SLC9A1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115928114-B | Synthetic method of aromatic hydrocarbon pyrazole compound | 淮北师范大学 | 2023-06-27 | — | — | CN | disclosed |
| CN-115928114-A | Synthetic method of aromatic pyrazole compound | 淮北师范大学 | 2023-04-07 | — | — | CN | disclosed |