Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR7 | P34969 | 3/20 | 0.43 |
| ▸ | HTR1A | P08908 | 2/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.41 |
| ▸ | KMO | O15229 | 1/20 | 0.40 |
| ▸ | AURKA | O14965 | 2/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | PRKACA | P17612 | 1/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.38 |
| ▸ | PIM1 | P11309 | 6/20 | 0.38 |
| ▸ | PIM3 | Q86V86 | 5/20 | 0.38 |
| ▸ | PIM2 | Q9P1W9 | 5/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | CHUK | O15111 | 1/20 | 0.36 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.36 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.36 |
| ▸ | CDK2 | P24941 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3715554 | 0.77 | PIM1 (0.46) | HRH3KMOAURKAHSP90AA1PRKACA | |
| SCHEMBL3719906 | 0.72 | ROCK2 (0.45) | HTR7HTR1AAURKAPIM1PIM3 | |
| SCHEMBL3720566 | 0.69 | KMO (0.43) | KMOAURKAHSP90AA1PRKACAADORA2A | |
| SCHEMBL10533843 | 0.67 | HTR7 (0.59) | HTR7HTR1ADRD2HTR2A | |
| SCHEMBL5225822 | 0.67 | MEN1 (0.54) | HRH3AURKAHSP90AA1PRKACAADORA2A | |
| SCHEMBL3656028 | 0.67 | ROCK2 (0.60) | HRH3KMOAURKAHSP90AA1PRKACA | |
| SCHEMBL4703487 | 0.66 | MEN1 (0.53) | HRH3AURKAHSP90AA1PRKACAADORA2A | |
| SCHEMBL4704184 | 0.65 | HSP90AA1 (0.53) | HTR7KMOAURKAHSP90AA1PRKACA | |
| SCHEMBL3713494 | 0.64 | CDK2 (0.39) | KMOAURKAHSP90AA1PRKACAADORA2A | |
| SCHEMBL10918299 | 0.62 | KMO (0.57) | KMOAURKAHSP90AA1PRKACAADORA2A |
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 |