Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.38 |
| ▸ | HPGD | P15428 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.36 |
| ▸ | SNCA | P37840 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CDK2 | P24941 | 4/20 | 0.35 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.35 |
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL14613374 | 0.95 | SLC6A5 (0.40) | GSK3BALDH1A1HPGDKDM4ECA1 | |
| SCHEMBL14613272 | 0.86 | GSK3B (0.42) | GSK3BCDK2CCNE1 | |
| SCHEMBL14051094 | 0.83 | PPARG (0.45) | ALDH1A1HPGDKDM4ELMNAHSD17B10 | |
| SCHEMBL14613407 | 0.83 | PPARG (0.45) | ALDH1A1HPGDKDM4ELMNAHSD17B10 | |
| SCHEMBL12954198 | 0.83 | GSK3B (0.42) | GSK3BHPGDMAPTMEN1KMT2A | |
| SCHEMBL14043329 | 0.82 | KISS1R (0.38) | GSK3BCDK2CCNE1KISS1R | |
| SCHEMBL13120332 | 0.81 | CDK2 (0.57) | GSK3BLMNAMAPTTP53CDK2 | |
| SCHEMBL14613332 | 0.81 | MEN1 (0.37) | GSK3BMEN1KMT2ACDK2CCNE1 | |
| SCHEMBL12953902 | 0.80 | SIRT1 (0.41) | MEN1KMT2A | |
| SCHEMBL14545832 | 0.80 | CDK2 (0.48) | GSK3BALDH1A1HPGDLMNAMAPT |
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-1720882-B1 | PYRAZOLOPYRIMIDINE-DERIVATIVES AS CYCLIN DEPENDENT KINASE INHIBITORS | SCHERING CORP (US) | 2011-01-05 | — | — | EP | disclosed |