Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 4/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | RAPGEF3 | O95398 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.35 |
| ▸ | NQO2 | P16083 | 1/20 | 0.35 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.35 |
| ▸ | F2 | P00734 | 2/20 | 0.34 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.34 |
| ▸ | PRSS2 | P07478 | 2/20 | 0.34 |
| ▸ | PRSS3 | P35030 | 2/20 | 0.34 |
| ▸ | LCK | P06239 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5151649 | 0.79 | HTT (0.48) | GAALMNAALDH1A1HTTPKM | |
| SCHEMBL5151645 | 0.79 | HTT (0.48) | GAALMNAALDH1A1HTTPKM | |
| SCHEMBL14336285 | 0.79 | HTT (0.48) | GAALMNAALDH1A1HTTPKM | |
| SCHEMBL24686355 | 0.78 | GAA (0.49) | GAALMNAALDH1A1MAPTTSHR | |
| SCHEMBL27715369 | 0.77 | LMNA (0.42) | GAALMNAALDH1A1MAPTTSHR | |
| SCHEMBL19551921 | 0.77 | LMNA (0.44) | GAALMNAALDH1A1MAPTKDM4E | |
| SCHEMBL19551919 | 0.77 | LMNA (0.44) | GAALMNAALDH1A1MAPTKDM4E | |
| SCHEMBL29718844 | 0.77 | LMNA (0.44) | GAALMNAALDH1A1MAPTKDM4E | |
| SCHEMBL10642047 | 0.75 | GAA (0.54) | GAALMNATSHRMAPK1HTT | |
| SCHEMBL10642042 | 0.75 | GAA (0.54) | GAALMNATSHRMAPK1HTT |
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 |
|---|---|---|---|---|---|---|---|
| US-7312225-B2 | Macrocyclic pyrimidines, their production and use as pharmaceutical agents | BAYER SCHERING PHARMA AG (DE) | 2007-12-25 | — | — | US | disclosed |