Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 9/20 | 0.42 |
| ▸ | CHUK | O15111 | 7/20 | 0.42 |
| ▸ | LCK | P06239 | 2/20 | 0.42 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.42 |
| ▸ | SUV39H2 | Q9H5I1 | 3/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | BACE1 | P56817 | 1/20 | 0.38 |
| ▸ | P2RX3 | P56373 | 2/20 | 0.37 |
| ▸ | ROCK2 | O75116 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1705165 | 1.00 | IKBKB (0.42) | IKBKBCHUKLCKROCK1SUV39H2 | |
| SCHEMBL1705167 | 1.00 | IKBKB (0.42) | IKBKBCHUKLCKROCK1SUV39H2 | |
| SCHEMBL1705241 | 0.92 | IKBKB (0.43) | IKBKBCHUKLCKROCK1HRH3 | |
| SCHEMBL1705243 | 0.92 | IKBKB (0.43) | IKBKBCHUKLCKROCK1HRH3 | |
| SCHEMBL1706038 | 0.92 | IKBKB (0.43) | IKBKBCHUKLCKROCK1HRH3 | |
| SCHEMBL1705547 | 0.92 | IKBKB (0.44) | IKBKBCHUKLCKROCK1SUV39H2 | |
| SCHEMBL1705546 | 0.92 | IKBKB (0.44) | IKBKBCHUKLCKROCK1SUV39H2 | |
| SCHEMBL1704725 | 0.90 | IKBKB (0.47) | IKBKBCHUKLCKROCK1SUV39H2 | |
| SCHEMBL1704723 | 0.90 | IKBKB (0.47) | IKBKBCHUKLCKROCK1SUV39H2 | |
| SCHEMBL1705209 | 0.88 | IKBKB (0.42) | IKBKBCHUKLCKROCK1ROCK2 |
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-2125746-B1 | CYCLOALKYLAMINE SUBSTITUTED ISOQUINOLINE DERIVATIVES | SANOFI SA (FR) | 2012-04-18 | — | — | EP | disclosed |