Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 6/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | HCRTR1 | O43613 | 2/20 | 0.43 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.43 |
| ▸ | MET | P08581 | 5/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL3400915 | 0.81 | HRH3 (0.50) | HRH3METKCNH2 | |
| SCHEMBL3274929 | 0.74 | MET (0.53) | HRH3POLBMETALDH1A1 | |
| SCHEMBL3274932 | 0.74 | MET (0.53) | HRH3POLBMETALDH1A1 | |
| SCHEMBL3282430 | 0.74 | MET (0.53) | HRH3POLBMETALDH1A1 | |
| SCHEMBL3275537 | 0.73 | MET (0.48) | HRH3METKCNH2 | |
| SCHEMBL3275541 | 0.73 | MET (0.48) | HRH3METKCNH2 | |
| Hydrochloric Acid SCHEMBL3275163 | 0.73 | MET (0.52) | HRH3POLBMETALDH1A1 | |
| Hydrochloric Acid SCHEMBL3275160 | 0.73 | MET (0.52) | HRH3POLBMETALDH1A1 | |
| SCHEMBL10314339 | 0.73 | HRH3 (0.46) | HRH3POLBHCRTR1HCRTR2ALDH1A1 | |
| SCHEMBL3275616 | 0.71 | MET (0.48) | HRH3POLBHCRTR1HCRTR2MET |
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-2247588-A2 | FUSED HETEROCYCLIC DERIVATIVE AND USE THEREOF | Takeda Pharmaceutical Company Limited (JP) | 2010-11-10 | — | — | EP | disclosed |
| WO-2009107850-A2 | FUSED HETEROCYCLIC DERIVATIVE AND USE THEREOF | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2009-09-03 | — | — | WO | disclosed |