Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 9/20 | 0.58 |
| ▸ | NR1H3 | Q13133 | 9/20 | 0.58 |
| ▸ | RXRA | P19793 | 1/20 | 0.45 |
| ▸ | GABRA2 | P47869 | 3/20 | 0.39 |
| ▸ | AXL | P30530 | 2/20 | 0.37 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.37 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | ADRA1B | P35368 | 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 | |
|---|---|---|---|---|
| SCHEMBL4010852 | 0.89 | NR1H2 (0.56) | NR1H2NR1H3RXRAAXLMAPK14 | |
| SCHEMBL4012216 | 0.89 | NR1H2 (0.56) | NR1H2NR1H3RXRASCN9APTGDR2 | |
| SCHEMBL4017304 | 0.88 | NR1H2 (0.46) | NR1H2NR1H3RXRAAXLMAPK14 | |
| SCHEMBL4009472 | 0.87 | NR1H2 (0.58) | NR1H2NR1H3RXRAPTGDR2 | |
| SCHEMBL4011474 | 0.86 | NR1H2 (0.74) | NR1H2NR1H3RXRAHTR1AADRA1D | |
| SCHEMBL4011231 | 0.83 | NR1H2 (0.47) | NR1H2NR1H3RXRAAXLMAPK14 | |
| SCHEMBL4015147 | 0.82 | NR1H2 (0.50) | NR1H2NR1H3RXRAAXLMAPK14 | |
| SCHEMBL4013074 | 0.81 | NR1H2 (0.42) | NR1H2NR1H3RXRAAXLMAPK14 | |
| SCHEMBL4016946 | 0.80 | HTR1A (0.47) | MAPK14PTGDR2HTR1AADRA1DADRA1A | |
| SCHEMBL4012481 | 0.80 | NR1H2 (0.67) | NR1H2NR1H3RXRA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2074098-A2 | QUINOLINE COMPOUNDS | Wyeth (US) | 2009-07-01 | — | — | EP | claimed |
| WO-2008049047-A2 | QUINOLINE COMPOUNDS | WYETH (US) | 2008-04-24 | — | — | WO | claimed |
| EP-2074098-A2 | QUINOLINE COMPOUNDS | Wyeth (US) | 2009-07-01 | — | — | EP | disclosed |
| WO-2008049047-A2 | QUINOLINE COMPOUNDS | WYETH (US) | 2008-04-24 | — | — | WO | disclosed |