Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 2/20 | 0.43 |
| ▸ | PI4KA | P42356 | 2/20 | 0.36 |
| ▸ | PI4K2B | Q8TCG2 | 2/20 | 0.36 |
| ▸ | PI4K2A | Q9BTU6 | 2/20 | 0.36 |
| ▸ | PI4KB | Q9UBF8 | 2/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.35 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.35 |
| ▸ | MAP4K4 | O95819 | 6/20 | 0.35 |
| ▸ | CSNK1A1 | P48729 | 2/20 | 0.34 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.33 |
| ▸ | PDE5A | O76074 | 1/20 | 0.33 |
| ▸ | CDC7 | O00311 | 1/20 | 0.33 |
| ▸ | PLK4 | O00444 | 1/20 | 0.33 |
| ▸ | AURKA | O14965 | 1/20 | 0.33 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.33 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.33 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.33 |
| ▸ | PRKD3 | O94806 | 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 | |
|---|---|---|---|---|
| SCHEMBL10104557 | 0.85 | CDK1 (0.42) | CDK1ADORA2AADORA1CSNK1A1CLK4 | |
| SCHEMBL22715140 | 0.82 | CDC7 (0.38) | CDK1PI4KAPI4K2BPI4K2API4KB | |
| SCHEMBL29439775 | 0.82 | CDC7 (0.38) | CDK1PI4KAPI4K2BPI4K2API4KB | |
| SCHEMBL7938941 | 0.81 | CDK1 (0.45) | CDK1ADORA2AADORA1CSNK1A1CLK4 | |
| SCHEMBL7938906 | 0.77 | ADORA2A (0.45) | CDK1PI4KAPI4K2BPI4K2API4KB | |
| SCHEMBL22715904 | 0.72 | ADORA2A (0.39) | PI4KAPI4K2BPI4K2API4KBADORA2A | |
| SCHEMBL29439732 | 0.72 | ADORA2A (0.39) | PI4KAPI4K2BPI4K2API4KBADORA2A | |
| SCHEMBL6359268 | 0.72 | CDK1 (0.39) | CDK1CSNK1A1CLK4 | |
| SCHEMBL22715627 | 0.71 | ADORA2A (0.37) | PI4KAPI4K2BPI4K2API4KBADORA2A | |
| SCHEMBL29439817 | 0.71 | ADORA2A (0.37) | PI4KAPI4K2BPI4K2API4KBADORA2A |
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 |
|---|---|---|---|---|---|---|---|
| US-6232312-B1 | ADMINISTERING A COMBINATION OF INDENE AND PYRIMIDO(5,4-D)PYRIMIDINE DERIVATIVES TO TREAT PREPANCREATIC CANCER | CELL PATHWAYS, INC. | 2001-05-15 | — | — | US | disclosed |