Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | NCF1 | P14598 | 1/20 | 0.34 |
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.32 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.32 |
| ▸ | HTR3B | O95264 | 1/20 | 0.32 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.32 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.32 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.32 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.32 |
| ▸ | HRH1 | P35367 | 1/20 | 0.32 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.32 |
| ▸ | HTR3A | P46098 | 1/20 | 0.32 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.32 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.32 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.32 |
| ▸ | HTR2B | P41595 | 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 | |
|---|---|---|---|---|
| SCHEMBL16707764 | 0.90 | LMNA (0.39) | MAPK1ALDH1A1NCF1HSD11B1LMNA | |
| SCHEMBL25465131 | 0.90 | LMNA (0.39) | MAPK1ALDH1A1NCF1HSD11B1LMNA | |
| SCHEMBL272828 | 0.85 | MAPK1 (0.48) | MAPK1TMEM97HTR3EHTR3BCHRM4 | |
| SCHEMBL23101730 | 0.85 | MAPK1 (0.48) | MAPK1TMEM97HTR3EHTR3BCHRM4 | |
| SCHEMBL14320158 | 0.79 | MAPK1 (0.57) | MAPK1TMEM97HTR3EHTR3BCHRM4 | |
| SCHEMBL410993 | 0.79 | MAPK1 (0.57) | MAPK1TMEM97HTR3EHTR3BCHRM4 | |
| SCHEMBL22565449 | 0.78 | LMNA (0.42) | ALDH1A1NCF1LMNACYP2C9 | |
| SCHEMBL44881 | 0.76 | — | — | |
| SCHEMBL278483 | 0.76 | MAPK1 (0.55) | MAPK1ALDH1A1TMEM97HTR3EHTR3B | |
| SCHEMBL22311884 | 0.76 | — | — |
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-3305785-A1 | PYRIDO[3,4-d]PYRIMIDINE DERIVATIVE AND PHARMACEUTICALLY ACCEPTABLE SALT THEREOF | Teijin Pharma Limited (JP) | 2018-04-11 | — | — | EP | disclosed |