Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 9/20 | 0.50 |
| ▸ | NR1H3 | Q13133 | 9/20 | 0.50 |
| ▸ | ATP4A | P20648 | 1/20 | 0.41 |
| ▸ | ATP4B | P51164 | 1/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.38 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL27673874 | 0.85 | NR1H2 (0.55) | NR1H2NR1H3 | |
| SCHEMBL27653831 | 0.78 | NR1H2 (0.43) | NR1H2NR1H3ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL4012188 | 0.77 | NR1H2 (0.63) | NR1H2NR1H3 | |
| SCHEMBL27673881 | 0.76 | NR1H2 (0.58) | NR1H2NR1H3 | |
| SCHEMBL1125385 | 0.75 | NR1H2 (0.52) | NR1H2NR1H3 | |
| SCHEMBL27775437 | 0.74 | TSHR (0.44) | NR1H2AKR1C3AKR1C2ALDH1A1CYP1A2 | |
| SCHEMBL27653828 | 0.74 | NR1H2 (0.53) | NR1H2NR1H3 | |
| SCHEMBL27673864 | 0.72 | TRPA1 (0.39) | NR1H2AKR1C3AKR1C2ALDH1A1CYP1A2 | |
| SCHEMBL34599 | 0.72 | NR1H2 (0.65) | NR1H2NR1H3 | |
| SCHEMBL1125462 | 0.71 | NR1H2 (0.53) | NR1H2NR1H3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101541751-A | Quinoline compounds | WYETH CORP (US) | 2009-09-23 | — | — | CN | disclosed |