Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 2/20 | 0.44 |
| ▸ | NR1H2 | P55055 | 3/20 | 0.42 |
| ▸ | NR1H3 | Q13133 | 3/20 | 0.42 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.42 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | NAMPT | P43490 | 3/20 | 0.39 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | DDX3X | O00571 | 1/20 | 0.38 |
| ▸ | ANO1 | Q5XXA6 | 1/20 | 0.37 |
| ▸ | C5AR1 | P21730 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3857878 | 0.79 | NR1H2 (0.53) | ROCK2NR1H2NR1H3NR1I2NR3C1 | |
| SCHEMBL27730583 | 0.70 | NR1H2 (0.47) | NR1H2NR1H3NR1I2NR3C1 | |
| SCHEMBL5246499 | 0.68 | NR1H2 (0.35) | NR1H2NR1H3NR1I2NR3C1 | |
| SCHEMBL5283390 | 0.67 | SOS1 (0.43) | NR1H2NR1H3NR1I2NR3C1 | |
| SCHEMBL1414406 | 0.65 | NR1H2 (0.50) | NR1H2NR1H3NR1I2NR3C1DDX3X | |
| SCHEMBL4637492 | 0.65 | KMT2A (0.61) | ROCK2KMT2AMEN1MAPTHTT | |
| SCHEMBL5348609 | 0.64 | NR1H2 (0.45) | NR1H2NR1H3NR1I2NR3C1 | |
| SCHEMBL1407573 | 0.64 | NR1H2 (0.51) | NR1H2NR1H3NR1I2NR3C1NAMPT | |
| SCHEMBL1407166 | 0.63 | NR1H2 (0.56) | NR1H2NR1H3NR1I2NR3C1MAPT | |
| SCHEMBL29312949 | 0.63 | ROCK2 (0.67) | ROCK2KMT2AMEN1MAPTHTT |
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 |
|---|---|---|---|---|---|---|---|
| EP-2295429-A1 | 3-((hetero)aryl)-indazoles as Liver X receptor (LXR) and Th-1 inhibitors for the treatment of cardiovascular diseases | Wyeth LLC (US) | 2011-03-16 | — | — | EP | disclosed |