Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 2/20 | 0.37 |
| ▸ | CNR2 | P34972 | 2/20 | 0.37 |
| ▸ | FFAR2 | O15552 | 2/20 | 0.34 |
| ▸ | CCNE2 | O96020 | 2/20 | 0.33 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.33 |
| ▸ | CDK2 | P24941 | 2/20 | 0.33 |
| ▸ | SRC | P12931 | 1/20 | 0.33 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.33 |
| ▸ | TLR9 | Q9NR96 | 4/20 | 0.33 |
| ▸ | TLR7 | Q9NYK1 | 3/20 | 0.33 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.32 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.32 |
| ▸ | NOS1 | P29475 | 1/20 | 0.32 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL99741 | 0.88 | ALDH1A1 (0.41) | PIK3CACNR2FFAR2CCNE2CCNE1 | |
| SCHEMBL99474 | 0.79 | PIK3CA (0.35) | PIK3CACNR2SRC | |
| SCHEMBL99160 | 0.78 | ALDH1A1 (0.38) | PIK3CAFFAR2 | |
| SCHEMBL1674720 | 0.76 | PIK3CA (0.31) | PIK3CA | |
| SCHEMBL98898 | 0.76 | GSK3B (0.35) | PIK3CA | |
| SCHEMBL97904 | 0.75 | ALDH1A1 (0.44) | — | |
| SCHEMBL98824 | 0.74 | ALDH1A1 (0.40) | PIK3CACNR2SRCPDE10A | |
| SCHEMBL1620825 | 0.73 | ALDH1A1 (0.33) | PIK3CASRC | |
| SCHEMBL98136 | 0.71 | PIK3CA (0.43) | PIK3CACNR2TLR9TLR7PDE10A | |
| SCHEMBL100748 | 0.71 | CNR2 (0.35) | PIK3CACNR2SRCTLR9TLR7 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2426130-B1 | PURINE DERIVATIVE AND ANTITUMOR AGENT USING SAME | ZENYAKU KOGYO KK (JP) | 2015-03-11 | — | — | EP | disclosed |
| EP-2426130-A1 | PURINE DERIVATIVE AND ANTITUMOR AGENT USING SAME | ZENYAKU KOGYO KABUSHIKIKAISHA (JP) | 2012-03-07 | — | — | EP | disclosed |