Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 7/20 | 0.40 |
| ▸ | NR1H3 | Q13133 | 6/20 | 0.40 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | RORC | P51449 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | KMO | O15229 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.34 |
| ▸ | SLC40A1 | Q9NP59 | 1/20 | 0.34 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4174099 | 0.88 | PTGS2 (0.41) | NR1H2NR1H3ESR1KMOPTGS2 | |
| SCHEMBL4164422 | 0.85 | NR1H2 (0.38) | NR1H2NR1H3PPARGESR1KMO | |
| SCHEMBL4165443 | 0.81 | NR1H2 (0.44) | NR1H2NR1H3RORCESR1CYP1A2 | |
| SCHEMBL27765245 | 0.80 | NR1H2 (0.46) | NR1H2NR1H3SLC40A1 | |
| SCHEMBL28780790 | 0.79 | NR1H2 (0.37) | NR1H2NR1H3PPARGRORCESR1 | |
| SCHEMBL4164838 | 0.79 | SLC6A2 (0.36) | CYP1A2CYP2C19 | |
| SCHEMBL27786915 | 0.79 | ESR1 (0.40) | NR1H2NR1H3PPARGESR1CYP1A2 | |
| SCHEMBL27786978 | 0.78 | KDM4E (0.43) | NR1H2NR1H3PPARGRORCESR1 | |
| SCHEMBL28780789 | 0.78 | SLC40A1 (0.38) | NR1H2NR1H3KMOHSD11B1SLC40A1 | |
| SCHEMBL4165744 | 0.77 | PARP1 (0.44) | NR1H2NR1H3PPARGRORCCYP3A4 |
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-101541751-A | Quinoline compounds | WYETH CORP (US) | 2009-09-23 | — | — | CN | claimed |
| CN-101541751-A | Quinoline compounds | WYETH CORP (US) | 2009-09-23 | — | — | CN | disclosed |