Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 10/20 | 0.43 |
| ▸ | ROCK1 | Q13464 | 10/20 | 0.43 |
| ▸ | P2RX7 | Q99572 | 4/20 | 0.40 |
| ▸ | F2 | P00734 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | PRKD3 | O94806 | 2/20 | 0.36 |
| ▸ | PRKCG | P05129 | 2/20 | 0.36 |
| ▸ | PRKCB | P05771 | 2/20 | 0.36 |
| ▸ | PRKCA | P17252 | 2/20 | 0.36 |
| ▸ | PRKCH | P24723 | 2/20 | 0.36 |
| ▸ | PRKCI | P41743 | 2/20 | 0.36 |
| ▸ | PRKCE | Q02156 | 2/20 | 0.36 |
| ▸ | PRKCQ | Q04759 | 2/20 | 0.36 |
| ▸ | PRKCZ | Q05513 | 2/20 | 0.36 |
| ▸ | PRKCD | Q05655 | 2/20 | 0.36 |
| ▸ | PRKD1 | Q15139 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.36 |
| ▸ | FLT3 | P36888 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7321636 | 0.94 | ROCK2 (0.46) | ROCK2ROCK1P2RX7F2CYP3A4 | |
| SCHEMBL10496415 | 0.85 | ROCK2 (0.44) | ROCK2ROCK1P2RX7F2CYP3A4 | |
| SCHEMBL7326031 | 0.84 | ROCK2 (0.46) | ROCK2ROCK1P2RX7F2CYP3A4 | |
| SCHEMBL7326189 | 0.84 | ROCK2 (0.42) | ROCK2ROCK1P2RX7CYP3A4PRKD3 | |
| SCHEMBL7323326 | 0.82 | P2RX7 (0.43) | ROCK2ROCK1P2RX7CYP3A4PRKD3 | |
| SCHEMBL10496402 | 0.81 | ROCK2 (0.48) | ROCK2ROCK1P2RX7F2CYP3A4 | |
| SCHEMBL7316438 | 0.81 | ROCK2 (0.48) | ROCK2ROCK1P2RX7F2CYP3A4 | |
| SCHEMBL7327226 | 0.81 | ROCK2 (0.48) | ROCK2ROCK1P2RX7F2CYP3A4 | |
| SCHEMBL10496437 | 0.81 | ROCK2 (0.43) | ROCK2ROCK1P2RX7F2CYP3A4 | |
| SCHEMBL7326683 | 0.80 | P2RX7 (0.43) | ROCK2ROCK1P2RX7F2CYP3A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0287696-B1 | ISOQUINOLINE DERIVATIVES | Asahi Kasei Kogyo Kabushiki Kaisha (JP) | 1991-01-02 | — | — | EP | disclosed |
| US-4798897-A | (AMINOALKYL)AMINOSULFONYL-SUBSTITUTED CARDIOVASCULAR AND RESPIRATORY SYSTEM DISORDERS | ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) | 1989-01-17 | — | — | US | disclosed |
| EP-0287696-A1 | Isoquinoline derivatives | Asahi Kasei Kogyo Kabushiki Kaisha (JP) | 1988-10-26 | — | — | EP | disclosed |