Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.36 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 4/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 5/20 | 0.34 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.33 |
| ▸ | NR1H4 | Q96RI1 | 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 | |
|---|---|---|---|---|
| SCHEMBL13304739 | 0.89 | CYP3A4 (0.40) | CYP3A4RIPK1TP53KDM4EALDH1A1 | |
| SCHEMBL13305165 | 0.89 | GSK3B (0.43) | GSK3B | |
| SCHEMBL14050796 | 0.86 | CDK2 (0.39) | CYP3A4RIPK1TP53MAPTLMNA | |
| SCHEMBL14043152 | 0.82 | CALCA (0.35) | CYP3A4TP53MAPTLMNAPOLB | |
| SCHEMBL12953087 | 0.80 | GSK3B (0.43) | CYP3A4KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL13304916 | 0.79 | CYP3A4 (0.39) | CYP3A4RIPK1TP53KDM4EALDH1A1 | |
| SCHEMBL12953274 | 0.79 | GSK3B (0.43) | CYP3A4GSK3B | |
| SCHEMBL24962514 | 0.77 | CYP3A4 (0.37) | CYP3A4RIPK1TP53KDM4EALDH1A1 | |
| SCHEMBL14050897 | 0.77 | GSK3B (0.43) | TP53KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL12953267 | 0.77 | CDK2 (0.39) | CYP3A4RIPK1TP53NR1H4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008130570-A1 | NOVEL PYRAZOLOPYRIMIDINES AS CYCLIN DEPENDENT KINASE INHIBITORS | SCHERING CORPORATION (US) | 2008-10-30 | — | — | WO | disclosed |