Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 2/20 | 0.45 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.45 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | TNF | P01375 | 4/20 | 0.41 |
| ▸ | LITAF | Q99732 | 4/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11102035 | 0.83 | KCNH2 (0.56) | KCNH2HRH3KDM4EALDH1A1 | |
| SCHEMBL7571452 | 0.74 | HRH3 (0.50) | KCNH2HRH3CYP1A1CYP1A2CYP1B1 | |
| SCHEMBL2009260 | 0.71 | HRH3 (0.72) | KCNH2HRH3 | |
| SCHEMBL2005639 | 0.70 | HRH3 (0.54) | KCNH2HRH3 | |
| SCHEMBL1161541 | 0.70 | TNF (0.45) | KCNH2HRH3CYP1A1CYP1A2CYP1B1 | |
| SCHEMBL9106875 | 0.69 | IDO1 (0.59) | CYP1A1CYP1A2CYP1B1L3MBTL1KDM4E | |
| SCHEMBL25362087 | 0.69 | KMT2A (0.45) | SMN1; SMN2KDM4EHTTALDH1A1MEN1 | |
| SCHEMBL8408698 | 0.68 | HRH3 (0.57) | KCNH2HRH3KDM4EALDH1A1MEN1 | |
| SCHEMBL8408615 | 0.68 | HRH3 (0.57) | KCNH2HRH3KDM4EALDH1A1MEN1 | |
| SCHEMBL25362252 | 0.67 | KMT2A (0.43) | SMN1; SMN2L3MBTL1KDM4EHTTALDH1A1 |
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-0054132-A1 | Pyrimidones, their preparation and medicines containing them | Dr. Karl Thomae GmbH (DE) | 1982-06-23 | — | — | EP | disclosed |