Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.39 |
| ▸ | NR1H2 | P55055 | 7/20 | 0.39 |
| ▸ | NR1H3 | Q13133 | 7/20 | 0.39 |
| ▸ | HTR1A | P08908 | 2/20 | 0.39 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.39 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.39 |
| ▸ | RXRA | P19793 | 1/20 | 0.38 |
| ▸ | PDE4A | P27815 | 1/20 | 0.37 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.37 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.37 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.36 |
| ▸ | CDK9 | P50750 | 1/20 | 0.36 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.36 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.36 |
| ▸ | SLC40A1 | Q9NP59 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL4018578 | 0.88 | PTGDR2 (0.41) | PTGDR2NR1H2NR1H3HTR1AADRA1D | |
| SCHEMBL4012080 | 0.88 | NR1H2 (0.47) | PTGDR2NR1H2NR1H3HTR1ARXRA | |
| SCHEMBL4012347 | 0.85 | NR1H3 (0.45) | PTGDR2NR1H2NR1H3HTR1ARXRA | |
| SCHEMBL4013308 | 0.84 | HTR1A (0.47) | PTGDR2NR1H2NR1H3HTR1AADRA1D | |
| SCHEMBL4010967 | 0.84 | NR1H2 (0.53) | PTGDR2NR1H2NR1H3HTR1AADRA1D | |
| SCHEMBL4017522 | 0.80 | NR1H2 (0.45) | PTGDR2NR1H2NR1H3HTR1ARXRA | |
| SCHEMBL4011491 | 0.80 | NR1H2 (0.64) | NR1H2NR1H3RXRACDK9 | |
| SCHEMBL4010720 | 0.78 | NR1H2 (0.52) | PTGDR2NR1H2NR1H3HTR1AADRA1D | |
| SCHEMBL4013490 | 0.78 | NR1H2 (0.52) | NR1H2NR1H3RXRAMAPK14 | |
| SCHEMBL4012811 | 0.77 | NR1H2 (0.53) | PTGDR2NR1H2NR1H3HTR1AADRA1D |
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 |