Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 5/20 | 0.69 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.41 |
| ▸ | MELK | Q14680 | 1/20 | 0.41 |
| ▸ | JAK2 | O60674 | 1/20 | 0.41 |
| ▸ | JAK1 | P23458 | 1/20 | 0.41 |
| ▸ | TYK2 | P29597 | 1/20 | 0.41 |
| ▸ | JAK3 | P52333 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.41 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9621595 | 0.86 | ALDH1A1 (0.59) | ROCK2KDM4EMEN1ALDH1A1POLB | |
| SCHEMBL3801724 | 0.82 | HTT (0.54) | ROCK2MELKROCK1LRRK2 | |
| SCHEMBL3713992 | 0.82 | ROCK2 (1.00) | ROCK2KDM4EMEN1ALDH1A1POLB | |
| SCHEMBL3656438 | 0.77 | ALDH1A1 (0.67) | ROCK2KDM4EMEN1ALDH1A1POLB | |
| SCHEMBL3718200 | 0.76 | ROCK2 (0.61) | ROCK2HSD17B10ROCK1 | |
| SCHEMBL3714540 | 0.75 | ROCK2 (0.60) | ROCK2KDM4EMEN1ALDH1A1POLB | |
| SCHEMBL3722814 | 0.75 | ROCK2 (0.60) | ROCK2KDM4EMEN1ALDH1A1POLB | |
| SCHEMBL3808767 | 0.74 | ROCK2 (0.58) | ROCK2KDM4EMEN1ALDH1A1POLB | |
| SCHEMBL3714084 | 0.74 | ROCK2 (0.71) | ROCK2MELKROCK1 | |
| SCHEMBL3810004 | 0.74 | GSK3B (0.38) | ROCK2MAPTKMT2ATLR8GSK3B |
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 |