Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.47 |
| ▸ | AURKA | O14965 | 2/20 | 0.47 |
| ▸ | PRKACA | P17612 | 1/20 | 0.47 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.47 |
| ▸ | KMO | O15229 | 1/20 | 0.45 |
| ▸ | FEN1 | P39748 | 2/20 | 0.43 |
| ▸ | MAP3K14 | Q99558 | 2/20 | 0.43 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.42 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.42 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.42 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.42 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | CDK2 | P24941 | 2/20 | 0.40 |
| ▸ | CDK4 | P11802 | 1/20 | 0.40 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.40 |
| ▸ | CHUK | O15111 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28513246 | 0.83 | HSP90AA1 (0.53) | HSP90AA1AURKAPRKACAADORA2AKMO | |
| SCHEMBL30507455 | 0.83 | HSP90AA1 (0.53) | HSP90AA1AURKAPRKACAADORA2AKMO | |
| SCHEMBL3792630 | 0.80 | CDC7 (0.47) | PRKACAMAPK14CDK5GSK3BCDK2 | |
| SCHEMBL18495643 | 0.75 | FEN1 (0.48) | HSP90AA1AURKAPRKACAADORA2AKMO | |
| SCHEMBL3393995 | 0.73 | HSP90AA1 (0.55) | HSP90AA1AURKAPRKACAADORA2AKMO | |
| SCHEMBL27159221 | 0.72 | FEN1 (0.54) | HSP90AA1AURKAPRKACAADORA2AKMO | |
| SCHEMBL20467870 | 0.71 | MAP3K14 (0.45) | HSP90AA1AURKAPRKACAADORA2AKMO | |
| SCHEMBL30353577 | 0.70 | FEN1 (0.57) | HSP90AA1AURKAPRKACAADORA2AFEN1 | |
| SCHEMBL5140478 | 0.70 | FEN1 (0.57) | HSP90AA1AURKAPRKACAADORA2AFEN1 | |
| SCHEMBL30775416 | 0.70 | MAP3K14 (0.57) | PRKACAKMOFEN1MAP3K14KDM4E |
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 |