Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 3/20 | 0.42 |
| ▸ | CDC7 | O00311 | 1/20 | 0.42 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.42 |
| ▸ | PIM1 | P11309 | 1/20 | 0.42 |
| ▸ | PRKACA | P17612 | 1/20 | 0.42 |
| ▸ | CDK2 | P24941 | 1/20 | 0.42 |
| ▸ | GSK3B | P49841 | 1/20 | 0.42 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.42 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.42 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.40 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | PRKCI | P41743 | 1/20 | 0.38 |
| ▸ | BRAF | P15056 | 6/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL3805901 | 0.80 | ROCK2 (0.58) | ROCK2ROCK1 | |
| SCHEMBL3724438 | 0.78 | CYP1A2 (0.42) | CHRNB2CHRNA4HRH3CYP3A4CYP2D6 | |
| SCHEMBL3715554 | 0.77 | PIM1 (0.46) | PIM1PRKACACDK2HRH3ROCK1 | |
| SCHEMBL5096842 | 0.74 | MAPT (0.50) | CHRNB2CHRNA4HRH3 | |
| SCHEMBL3725350 | 0.74 | MAPT (0.36) | ROCK2CDC7MAP4K4PIM1PRKACA | |
| SCHEMBL4137082 | 0.73 | CYP2D6 (0.66) | CHRNB2CHRNA4HRH3BRAFCYP3A4 | |
| SCHEMBL3713952 | 0.73 | ROCK2 (0.51) | ROCK2PIM1CLK4HRH3ROCK1 | |
| SCHEMBL7387972 | 0.73 | MAPT (0.41) | CHRNB2CHRNA4HRH3 | |
| SCHEMBL20703483 | 0.72 | CHRNB2 (0.50) | CHRNB2CHRNA4HRH3CYP2D6CYP2C9 | |
| SCHEMBL5553179 | 0.71 | KDM4E (0.40) | PIM1CHRNB2CHRNA4HRH3 |
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-2234618-A1 | BENZOPYRANS AND ANALOGS AS RHO KINASE INHIBITORS | The Scripps Research Institute (US) | 2010-10-06 | — | — | EP | disclosed |
| WO-2009079008-A1 | BENZOPYRANS AND ANALOGS AS RHO KINASE INHIBITORS | FENG YANGBO (US) | 2009-06-25 | — | — | WO | disclosed |