Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 1/20 | 0.48 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.48 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.46 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.46 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
| ▸ | CNR2 | P34972 | 1/20 | 0.43 |
| ▸ | CES2 | O00748 | 1/20 | 0.42 |
| ▸ | CES1 | P23141 | 1/20 | 0.42 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL17825651 | 0.87 | ROCK2 (0.45) | ROCK2AOC3HDAC4HDAC7HDAC5 | |
| SCHEMBL31038318 | 0.86 | HDAC4 (0.47) | ROCK2AOC3HDAC4HDAC7HDAC5 | |
| SCHEMBL25242939 | 0.86 | HDAC4 (0.47) | ROCK2AOC3HDAC4HDAC7HDAC5 | |
| Hydrochloric Acid SCHEMBL7339178 | 0.85 | ROCK2 (0.44) | ROCK2AOC3HDAC4HDAC7HDAC5 | |
| Hydrochloric Acid SCHEMBL7379790 | 0.85 | ROCK2 (0.44) | ROCK2AOC3HDAC4HDAC7HDAC5 | |
| Hydrochloric Acid SCHEMBL7379773 | 0.85 | ROCK2 (0.44) | ROCK2AOC3HDAC4HDAC7HDAC5 | |
| SCHEMBL12073600 | 0.85 | HDAC4 (0.46) | AOC3HDAC4HDAC7HDAC5KDM4E | |
| SCHEMBL20826236 | 0.82 | HDAC4 (0.44) | AOC3HDAC4HDAC7HDAC5KDM4E | |
| SCHEMBL17798382 | 0.82 | ALDH1A1 (0.42) | ROCK2KDM4EKMT2A | |
| SCHEMBL30932899 | 0.82 | L3MBTL1 (0.55) | ROCK2AOC3KDM4E |
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-107522634-A | Biaryl ureas carboxylic acid derivates or its salt and its production and use | 复旦大学 | 2017-12-29 | — | — | CN | disclosed |