Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 3/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | SSTR1 | P30872 | 2/20 | 0.33 |
| ▸ | SSTR4 | P31391 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | DRD4 | P21917 | 1/20 | 0.32 |
| ▸ | PARP1 | P09874 | 1/20 | 0.32 |
| ▸ | KDM1A | O60341 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.31 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.31 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.31 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL476802 | 1.00 | EPHX1 (0.36) | EPHX1HDAC4KCNH2SSTR1SSTR4 | |
| SCHEMBL10060054 | 0.83 | EPHX1 (0.41) | EPHX1KCNH2POLBMAPK1OPRK1 | |
| SCHEMBL14486852 | 0.83 | EPHX1 (0.41) | EPHX1KCNH2POLBMAPK1OPRK1 | |
| Hydrochloric Acid SCHEMBL17560375 | 0.81 | EPHX1 (0.40) | EPHX1KCNH2POLBMAPK1OPRK1 | |
| Hydrochloric Acid SCHEMBL17560372 | 0.81 | EPHX1 (0.40) | EPHX1KCNH2POLBMAPK1OPRK1 | |
| SCHEMBL1778461 | 0.76 | EPHX1 (0.47) | EPHX1KCNH2POLBMAPK1OPRK1 | |
| SCHEMBL14222420 | 0.76 | EPHX1 (0.47) | EPHX1KCNH2POLBMAPK1OPRK1 | |
| SCHEMBL5320954 | 0.76 | EPHX1 (0.47) | EPHX1KCNH2POLBMAPK1OPRK1 | |
| SCHEMBL584883 | 0.74 | KCNH2 (0.39) | EPHX1HDAC4KCNH2POLBMAPK1 | |
| Hydrochloric Acid SCHEMBL17560408 | 0.74 | EPHX1 (0.45) | EPHX1KCNH2POLBMAPK1OPRK1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2411010-A1 | NOVEL AMINOPYRIDINE DERIVATIVES HAVING AURORA A SELECTIVE INHIBITORY ACTION | MSD K.K. (JP) | 2012-02-01 | — | — | EP | disclosed |