Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK1 | Q13464 | 7/20 | 0.45 |
| ▸ | HRH1 | P35367 | 1/20 | 0.39 |
| ▸ | CCR3 | P51677 | 1/20 | 0.39 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.39 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 3/20 | 0.38 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.38 |
| ▸ | PRKCD | Q05655 | 2/20 | 0.38 |
| ▸ | PRKX | P51817 | 1/20 | 0.38 |
| ▸ | PRKCE | Q02156 | 1/20 | 0.38 |
| ▸ | PRKD1 | Q15139 | 1/20 | 0.38 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.37 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.37 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.36 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.35 |
| ▸ | PRKACA | P17612 | 1/20 | 0.35 |
| ▸ | PRKG1 | Q13976 | 1/20 | 0.35 |
| ▸ | PKN1 | Q16512 | 1/20 | 0.35 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.35 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4968833 | 1.00 | ROCK1 (0.45) | ROCK1HRH1CCR3MTNR1AMTNR1B | |
| SCHEMBL4980452 | 0.88 | ROCK1 (0.61) | ROCK1HRH1CCR3MTNR1AMTNR1B | |
| SCHEMBL4980445 | 0.88 | ROCK1 (0.61) | ROCK1HRH1CCR3MTNR1AMTNR1B | |
| SCHEMBL4009152 | 0.86 | CHEK2 (0.48) | ROCK1MTNR1AMTNR1BCHEK2 | |
| SCHEMBL4009155 | 0.86 | CHEK2 (0.48) | ROCK1MTNR1AMTNR1BCHEK2 | |
| SCHEMBL4965892 | 0.81 | ROCK1 (0.59) | ROCK1ROCK2PRKCDPRKXPRKCE | |
| SCHEMBL4965898 | 0.81 | ROCK1 (0.59) | ROCK1ROCK2PRKCDPRKXPRKCE | |
| SCHEMBL8938605 | 0.81 | ROCK1 (0.55) | ROCK1HRH1CCR3ROCK2PRKCD | |
| SCHEMBL4003696 | 0.76 | ROCK1 (0.75) | ROCK1PARP1ROCK2PRKCDPRKX | |
| SCHEMBL4003701 | 0.76 | ROCK1 (0.75) | ROCK1PARP1ROCK2PRKCDPRKX |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1963304-A1 | ISOQUINOLINE DERIVATIVES | N.V. Organon (NL) | 2008-09-03 | — | — | EP | disclosed |
| WO-2007065916-A1 | ISOQUINOLINE DERIVATIVES | N.V. ORGANON (NL) | 2007-06-14 | — | — | WO | disclosed |