Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP4K4 | O95819 | 1/20 | 0.62 |
| ▸ | NPBWR1 | P48145 | 2/20 | 0.53 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.53 |
| ▸ | MTOR | P42345 | 2/20 | 0.51 |
| ▸ | ATM | Q13315 | 2/20 | 0.51 |
| ▸ | PIK3C2A | O00443 | 1/20 | 0.51 |
| ▸ | PIK3C2B | O00750 | 1/20 | 0.51 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.51 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.51 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.51 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.51 |
| ▸ | PRKDC | P78527 | 1/20 | 0.51 |
| ▸ | ATR | Q13535 | 1/20 | 0.51 |
| ▸ | RPTOR | Q8N122 | 1/20 | 0.51 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.51 |
| ▸ | MLST8 | Q9BVC4 | 1/20 | 0.51 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.51 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.51 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.50 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL30704262 | 1.00 | MAP4K4 (0.62) | MAP4K4NPBWR1PIK3CDMTORATM | |
| SCHEMBL3560170 | 0.84 | MAP4K4 (0.46) | MAP4K4NPBWR1 | |
| SCHEMBL29711705 | 0.83 | MAP4K4 (0.62) | MAP4K4PIK3CDMTORATMPIK3C2A | |
| SCHEMBL12253728 | 0.83 | MAP4K4 (0.62) | MAP4K4PIK3CDMTORATMPIK3C2A | |
| SCHEMBL5318644 | 0.83 | ADORA2A (0.60) | MAP4K4ATMPIK3CBADORA2AADORA1 | |
| SCHEMBL16068085 | 0.81 | GRIN1 (0.55) | PIK3CDATMPIK3CAPIK3CBPIK3CG | |
| SCHEMBL29134978 | 0.81 | GRIN1 (0.55) | ATMADORA2AADORA1ALDH1A1PARP1 | |
| SCHEMBL13494884 | 0.81 | ADORA2A (0.43) | MAP4K4NPBWR1PIK3CDMTORATR | |
| SCHEMBL3414793 | 0.81 | MAP4K4 (0.58) | MAP4K4PIK3CDMTORPIK3CAMKNK2 | |
| SCHEMBL312533 | 0.80 | NPBWR1 (0.60) | MAP4K4NPBWR1PIK3CDMKNK2KIF11 |
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 |
|---|---|---|---|---|---|---|---|
| CN-117343004-A | Preparation method of 2-aminopyridine compound | 易简和成(江苏)医药科技有限公司 | 2024-01-05 | — | — | CN | disclosed |
| CN-102812006-B | Novel antimalaria reagent | MMV MEDICINES FOR MALARIA VENTURE (CH) | 2016-01-20 | — | — | CN | disclosed |