Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMO | O15229 | 1/20 | 0.43 |
| ▸ | JAK2 | O60674 | 3/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.41 |
| ▸ | AURKA | O14965 | 2/20 | 0.41 |
| ▸ | PRKACA | P17612 | 1/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.41 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.40 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.40 |
| ▸ | CAMKK2 | Q96RR4 | 1/20 | 0.40 |
| ▸ | CDK2 | P24941 | 4/20 | 0.40 |
| ▸ | CDC7 | O00311 | 4/20 | 0.40 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.40 |
| ▸ | DBF4 | Q9UBU7 | 1/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.40 |
| ▸ | GSK3B | P49841 | 2/20 | 0.40 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.40 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.40 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.40 |
| ▸ | CHUK | O15111 | 1/20 | 0.39 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3713494 | 0.72 | CDK2 (0.39) | KMOHSP90AA1AURKAPRKACAADORA2A | |
| SCHEMBL3715554 | 0.70 | PIM1 (0.46) | KMOHSP90AA1AURKAPRKACAADORA2A | |
| SCHEMBL3722649 | 0.69 | HTR7 (0.43) | KMOHSP90AA1AURKAPRKACAADORA2A | |
| SCHEMBL3661420 | 0.67 | CDK2 (0.44) | KMOHSP90AA1AURKAPRKACAADORA2A | |
| SCHEMBL27115833 | 0.66 | KMO (0.59) | KMOHSP90AA1AURKAPRKACAADORA2A | |
| SCHEMBL5397036 | 0.65 | MAPK1 (0.49) | JAK2HSP90AA1AURKAPRKACAADORA2A | |
| SCHEMBL4704184 | 0.65 | HSP90AA1 (0.53) | KMOHSP90AA1AURKAPRKACAADORA2A | |
| SCHEMBL7574364 | 0.65 | ALDH1A1 (0.46) | KDM4EALDH1A1MAPT | |
| SCHEMBL10918299 | 0.65 | KMO (0.57) | KMOJAK2HSP90AA1AURKAPRKACA | |
| SCHEMBL7584139 | 0.65 | HPGD (0.40) | KDM4EALDH1A1MAPT |
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 |