Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 4/20 | 0.46 |
| ▸ | CDK2 | P24941 | 4/20 | 0.44 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | CCR6 | P51684 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | GSR | P00390 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL13289474 | 0.98 | GSK3B (0.46) | GSK3BCDK2MAPTALDH1A1CYP1A2 | |
| SCHEMBL13289057 | 0.95 | GSK3B (0.46) | GSK3BCDK2MAPTALDH1A1CYP1A2 | |
| SCHEMBL13289270 | 0.95 | CDK2 (0.46) | GSK3BCDK2MAPTALDH1A1CYP1A2 | |
| SCHEMBL13289033 | 0.93 | GSK3B (0.45) | GSK3BCDK2MAPTALDH1A1CYP1A2 | |
| SCHEMBL13289514 | 0.93 | GSK3B (0.55) | GSK3BCDK2MAPTALDH1A1CYP1A2 | |
| SCHEMBL13288972 | 0.93 | CDK2 (0.44) | GSK3BCDK2MAPTALDH1A1CYP1A2 | |
| SCHEMBL13289252 | 0.92 | GSK3B (0.46) | GSK3BCDK2MAPTALDH1A1CYP1A2 | |
| SCHEMBL13289029 | 0.91 | GSK3B (0.47) | GSK3BCDK2MAPTALDH1A1CYP1A2 | |
| SCHEMBL12954453 | 0.91 | CDK2 (0.44) | GSK3BCDK2MAPTALDH1A1CYP1A2 | |
| SCHEMBL13289501 | 0.91 | ALDH1A1 (0.47) | GSK3BCDK2ALDH1A1POLBKMT2A |
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-2194058-A1 | Pyrazolopyrimidines suitable for the treatment of cancer diseases | SCHERING CORPORATION (US) | 2010-06-09 | — | — | EP | disclosed |