Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPKAPK2 | P49137 | 7/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.33 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.33 |
| ▸ | ATR | Q13535 | 1/20 | 0.32 |
| ▸ | TOP2A | P11388 | 1/20 | 0.32 |
| ▸ | TOP2B | Q02880 | 1/20 | 0.32 |
| ▸ | SYK | P43405 | 1/20 | 0.32 |
| ▸ | GSK3B | P49841 | 1/20 | 0.32 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | NAMPT | P43490 | 1/20 | 0.31 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.31 |
| ▸ | SREBF2 | Q12772 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL23619996 | 0.81 | MAPKAPK2 (0.35) | MAPKAPK2ALDH1A1DGAT1MAP4K4ATR | |
| SCHEMBL24714003 | 0.81 | ATR (0.42) | MAPKAPK2ALDH1A1MAP4K4ATRTOP2A | |
| SCHEMBL23619769 | 0.79 | KCNJ5 (0.41) | ALDH1A1 | |
| SCHEMBL23619944 | 0.75 | — | — | |
| SCHEMBL23620175 | 0.75 | — | — | |
| SCHEMBL23619734 | 0.67 | NAMPT (0.39) | ALDH1A1DGAT1TOP2ATOP2BSYK | |
| SCHEMBL1368674 | 0.67 | S1PR2 (0.58) | MAPKAPK2MAP4K4ATRTOP2ATOP2B | |
| SCHEMBL17336621 | 0.66 | TRPV1 (0.46) | MAPKAPK2ALDH1A1ATRSYKGSK3B | |
| SCHEMBL10288086 | 0.66 | GSK3B (0.54) | MAPKAPK2MAP4K4ATRSYKGSK3B | |
| SCHEMBL20525207 | 0.64 | MAPKAPK2 (0.40) | MAPKAPK2DGAT1MAP4K4ATRTOP2A |
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-4079724-A1 | FUSED RING COMPOUND AND APPLICATION THEREOF | Wuhan LL Science and Technology Development Co., Ltd. (CN) | 2022-10-26 | — | — | EP | disclosed |