Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 12/20 | 0.39 |
| ▸ | NR1H3 | Q13133 | 12/20 | 0.39 |
| ▸ | CD38 | P28907 | 3/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | RXRA | P19793 | 1/20 | 0.37 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | DRD4 | P21917 | 1/20 | 0.34 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
| ▸ | RORC | P51449 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4010841 | 0.88 | RORC (0.40) | NR1H2NR1H3RXRAESR1RORC | |
| SCHEMBL4015511 | 0.85 | ENPP1 (0.40) | CD38CYP3A4KCNH2ESR1ACVR1 | |
| SCHEMBL4012268 | 0.83 | NR1H2 (0.58) | NR1H2NR1H3RXRA | |
| SCHEMBL4014419 | 0.80 | NR1H2 (0.56) | NR1H2NR1H3RXRA | |
| SCHEMBL4013205 | 0.80 | NR1H2 (0.60) | NR1H2NR1H3RXRA | |
| SCHEMBL4011519 | 0.79 | NR1H2 (0.57) | NR1H2NR1H3RXRA | |
| SCHEMBL4012011 | 0.79 | NR1H3 (0.47) | NR1H2NR1H3RXRA | |
| SCHEMBL4012780 | 0.78 | CD38 (0.41) | NR1H2NR1H3CD38CYP3A4KCNH2 | |
| SCHEMBL4012475 | 0.77 | NR1H2 (0.58) | NR1H2NR1H3RXRA | |
| SCHEMBL4018578 | 0.73 | PTGDR2 (0.41) | NR1H2NR1H3RXRACHRM1DRD2 |
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-2074098-A2 | QUINOLINE COMPOUNDS | Wyeth (US) | 2009-07-01 | — | — | EP | disclosed |
| WO-2008049047-A2 | QUINOLINE COMPOUNDS | WYETH (US) | 2008-04-24 | — | — | WO | disclosed |