Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PI4KA | P42356 | 2/20 | 0.49 |
| ▸ | PI4K2B | Q8TCG2 | 2/20 | 0.49 |
| ▸ | PI4K2A | Q9BTU6 | 2/20 | 0.49 |
| ▸ | PI4KB | Q9UBF8 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | DRD3 | P35462 | 1/20 | 0.49 |
| ▸ | XDH | P47989 | 1/20 | 0.49 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.49 |
| ▸ | BRD4 | O60885 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | NT5C2 | P49902 | 1/20 | 0.44 |
| ▸ | TOP2A | P11388 | 1/20 | 0.43 |
| ▸ | BRAF | P15056 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28243803 | 0.85 | BRD4 (0.49) | PI4KAPI4K2BPI4K2API4KBLMNA | |
| SCHEMBL1749123 | 0.81 | PI4KA (0.53) | PI4KAPI4K2BPI4K2API4KBLMNA | |
| SCHEMBL27796380 | 0.79 | PI4KA (0.52) | PI4KAPI4K2BPI4K2API4KBLMNA | |
| SCHEMBL2843842 | 0.79 | TOP2A (0.51) | PI4KAPI4K2BPI4K2API4KBLMNA | |
| SCHEMBL5241436 | 0.77 | TSHR (0.54) | PI4KAPI4K2BPI4K2API4KBLMNA | |
| SCHEMBL4520816 | 0.77 | PI4KA (0.48) | PI4KAPI4K2BPI4K2API4KBLMNA | |
| SCHEMBL31456991 | 0.77 | MKNK1 (0.57) | LMNALRRK2BRD4TSHRMKNK1 | |
| SCHEMBL27376395 | 0.77 | MKNK1 (0.57) | LMNALRRK2BRD4TSHRMKNK1 | |
| SCHEMBL30484606 | 0.77 | TSHR (0.50) | PI4KAPI4K2BPI4K2API4KBLMNA | |
| SCHEMBL20207317 | 0.75 | DYRK1A (0.46) | GAA |
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-108602825-A | Purine compounds having anticancer activity | 中央研究院 | 2018-09-28 | — | — | CN | disclosed |