Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 6/20 | 0.50 |
| ▸ | GSK3B | P49841 | 5/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | NAMPT | P43490 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.37 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL12954106 | 0.92 | CYP19A1 (0.44) | CDK2GSK3BCYP19A1OPRM1OPRD1 | |
| SCHEMBL13120697 | 0.91 | CDK2 (0.63) | CDK2GSK3BCYP19A1CCNA2CCNA1 | |
| SCHEMBL13289053 | 0.90 | CDK2 (0.53) | CDK2GSK3BPOLBMEN1KMT2A | |
| SCHEMBL13289052 | 0.90 | CDK2 (0.53) | CDK2GSK3BCYP19A1POLBMEN1 | |
| SCHEMBL14545999 | 0.90 | CDK2 (0.54) | CDK2GSK3BPOLBALDH1A1CYP1A2 | |
| SCHEMBL14546000 | 0.89 | CDK2 (0.53) | CDK2GSK3BCYP19A1POLBALDH1A1 | |
| SCHEMBL12954278 | 0.85 | CDK2 (0.52) | CDK2GSK3BCYP19A1POLBMEN1 | |
| SCHEMBL13288973 | 0.84 | CDK2 (0.48) | CDK2GSK3BCYP19A1OPRM1OPRK1 | |
| SCHEMBL13288866 | 0.84 | CDK2 (0.59) | CDK2GSK3BMEN1KMT2ARAB9A | |
| SCHEMBL13289141 | 0.82 | CDK2 (0.53) | CDK2GSK3BRAB9ACCNA2CCNA1 |
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 |