Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMO | O15229 | 4/20 | 0.57 |
| ▸ | BCHE | P06276 | 1/20 | 0.52 |
| ▸ | MAOA | P21397 | 1/20 | 0.52 |
| ▸ | ACHE | P22303 | 1/20 | 0.52 |
| ▸ | MAOB | P27338 | 1/20 | 0.52 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.49 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.49 |
| ▸ | JAK2 | O60674 | 2/20 | 0.48 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.48 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.48 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.48 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.48 |
| ▸ | KIT | P10721 | 1/20 | 0.44 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.44 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.44 |
| ▸ | ADCY10 | Q96PN6 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.42 |
| ▸ | MET | P08581 | 1/20 | 0.42 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL3664819 | 0.86 | KMO (0.59) | KMOBCHEMAOAACHEMAOB | |
| SCHEMBL4705549 | 0.77 | ALDH1A1 (0.52) | BCHEMAOAACHEMAOBJAK2 | |
| SCHEMBL3946646 | 0.76 | CYP2D6 (0.50) | BCHEMAOAACHEMAOBHSP90AA1 | |
| SCHEMBL15741737 | 0.74 | ALDH1A1 (0.59) | MAOBTSHR | |
| SCHEMBL214175 | 0.74 | KDM4E (0.53) | MAOBMAPK14TSHR | |
| SCHEMBL3656028 | 0.74 | ROCK2 (0.60) | KMOHSP90AA1PDPK1CCNA2CDK2 | |
| SCHEMBL1924882 | 0.73 | LGMN (0.52) | MAOBJAK2TSHR | |
| Hydrochloric Acid SCHEMBL14784484 | 0.73 | TSHR (0.51) | MAOBTSHR | |
| SCHEMBL4080135 | 0.72 | LTA4H (0.56) | BCHEMAOAACHEMAOB | |
| SCHEMBL31125110 | 0.72 | HRH2 (0.53) | BCHEMAOAACHEMAOBTSHR |
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 |