Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSF1 | Q00613 | 1/20 | 0.50 |
| ▸ | ROCK2 | O75116 | 12/20 | 0.46 |
| ▸ | MKNK1 | Q9BUB5 | 3/20 | 0.45 |
| ▸ | ROCK1 | Q13464 | 7/20 | 0.44 |
| ▸ | EGFR | P00533 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | NOS1 | P29475 | 1/20 | 0.43 |
| ▸ | SYK | P43405 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6783321 | 0.83 | HSF1 (0.56) | HSF1ROCK2MKNK1ROCK1EGFR | |
| SCHEMBL18188387 | 0.82 | HSF1 (0.67) | HSF1ROCK2MKNK1ROCK1POLB | |
| SCHEMBL6782660 | 0.80 | HSF1 (0.53) | HSF1ROCK2MKNK1ROCK1EGFR | |
| SCHEMBL18188330 | 0.80 | MKNK1 (0.52) | ROCK2MKNK1ROCK1EGFRPOLB | |
| SCHEMBL29543562 | 0.80 | MKNK1 (0.52) | ROCK2MKNK1ROCK1EGFRPOLB | |
| SCHEMBL6909983 | 0.78 | HSF1 (0.51) | HSF1ROCK2MKNK1ROCK1EGFR | |
| SCHEMBL27595864 | 0.78 | PIK3CA (0.47) | HSF1ROCK2ROCK1MAPT | |
| SCHEMBL9985978 | 0.76 | HSF1 (0.47) | HSF1ROCK2MKNK1ROCK1 | |
| SCHEMBL6782806 | 0.74 | MAPT (0.46) | HSF1MAPTNOS1SYK | |
| SCHEMBL6787283 | 0.73 | HSF1 (0.72) | HSF1ROCK2MKNK1ROCK1EGFR |
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-1610667-A | 3-nitropyridine derivaives and the pharmaceutical compositions containing said derivatives | DONG WHA PHARM IND CO LTD (KR) | 2005-04-27 | — | — | CN | disclosed |