Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCD | O00767 | 1/20 | 0.35 |
| ▸ | HRH4 | Q9H3N8 | 3/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.34 |
| ▸ | PI4KB | Q9UBF8 | 4/20 | 0.33 |
| ▸ | KMO | O15229 | 3/20 | 0.33 |
| ▸ | LPAR1 | Q92633 | 2/20 | 0.32 |
| ▸ | ABCC3 | O15438 | 2/20 | 0.32 |
| ▸ | ABCC4 | O15439 | 2/20 | 0.32 |
| ▸ | SLCO1B3 | Q9NPD5 | 2/20 | 0.32 |
| ▸ | SLCO1B1 | Q9Y6L6 | 2/20 | 0.32 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.32 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.32 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.32 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.32 |
| ▸ | PPARD | Q03181 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL24439385 | 0.92 | ABCC3 (0.34) | KMOLPAR1ABCC3ABCC4SLCO1B3 | |
| SCHEMBL24439699 | 0.91 | SCD (0.35) | SCDHRH4HRH3PI4KBLPAR1 | |
| SCHEMBL29672272 | 0.90 | LPAR1 (0.44) | SCDPI4KBLPAR1ABCC3ABCC4 | |
| SCHEMBL24439677 | 0.89 | LPAR1 (0.38) | SCDPI4KBLPAR1ABCC3ABCC4 | |
| SCHEMBL24439373 | 0.86 | EPHX1 (0.42) | KMOMEN1KMT2A | |
| SCHEMBL24439463 | 0.85 | SLCO1B1 (0.42) | KMOLPAR1ABCC3ABCC4SLCO1B3 | |
| SCHEMBL24441041 | 0.83 | LPAR1 (0.40) | LPAR1EPHX2MEN1KMT2A | |
| SCHEMBL24439719 | 0.83 | SLCO1B1 (0.48) | KMOLPAR1ABCC3ABCC4SLCO1B3 | |
| SCHEMBL24441577 | 0.83 | EPHX2 (0.35) | KMOLPAR1ABCC3ABCC4SLCO1B3 | |
| SCHEMBL29672231 | 0.82 | SLCO1B1 (0.47) | LPAR1ABCC3ABCC4SLCO1B3SLCO1B1 |
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-2022100624-A1 | OXY-SUBSTITUTED AMINOCARBONATE THIOPHENE-BASED COMPOUND AND USE THEREOF | 武汉人福创新药物研发中心有限公司 | 2022-05-19 | — | — | WO | disclosed |