Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNC | P24863 | 1/20 | 0.41 |
| ▸ | CDK8 | P49336 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.38 |
| ▸ | NQO2 | P16083 | 1/20 | 0.38 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.38 |
| ▸ | CDK2 | P24941 | 2/20 | 0.37 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.36 |
| ▸ | FEN1 | P39748 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 3/20 | 0.36 |
| ▸ | GSK3B | P49841 | 2/20 | 0.36 |
| ▸ | CDC7 | O00311 | 1/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.36 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.36 |
| ▸ | PRKACA | P17612 | 1/20 | 0.36 |
| ▸ | HIPK2 | Q9H2X6 | 1/20 | 0.36 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.36 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.36 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.36 |
| ▸ | LATS1 | O95835 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4693972 | 0.84 | GAA (0.47) | CCNCCDK8GAAADORA2ANQO2 | |
| SCHEMBL23143338 | 0.71 | LMNA (0.42) | GAACDK2CDC7ROCK2PRKCH | |
| SCHEMBL3068958 | 0.71 | HSP90AA1 (0.56) | MKNK2 | |
| SCHEMBL25256670 | 0.69 | GAA (0.52) | CCNCCDK8GAACDK2KDR | |
| SCHEMBL17610095 | 0.68 | CDK2 (0.40) | ADORA2ACDK2ALOX5APFEN1KDR | |
| SCHEMBL14246417 | 0.68 | ABL1 (0.66) | CCNCCDK8GAACDK2ALOX5AP | |
| SCHEMBL27736014 | 0.67 | PDPK1 (0.41) | ADORA2ACDK2ALOX5APFEN1KDR | |
| SCHEMBL27715110 | 0.67 | ALOX5AP (0.43) | NQO2ADORA2BCDK2ALOX5APFEN1 | |
| SCHEMBL31301252 | 0.67 | GSK3B (0.59) | CCNCCDK8GAACDK2GSK3B | |
| SCHEMBL3362503 | 0.66 | HSP90AA1 (0.50) | ADORA2ACDK2ALOX5APFEN1IDO1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101268064-A | Pyrazine derivatives useful as adenosine receptor antagonists | ALMIRALL LAB (ES) | 2008-09-17 | — | — | CN | disclosed |