Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAMPT | P43490 | 1/20 | 0.42 |
| ▸ | APP | P05067 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | RPS6KA2 | Q15349 | 1/20 | 0.32 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.32 |
| ▸ | PI4KA | P42356 | 1/20 | 0.32 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.32 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.32 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.32 |
| ▸ | VNN1 | O95497 | 1/20 | 0.32 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.32 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.31 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.31 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.31 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.31 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.31 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.31 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL21440027 | 0.83 | NAMPT (0.42) | NAMPTAPPRPS6KA2CACNA1HPI4KA | |
| SCHEMBL4044984 | 0.79 | NAMPT (0.50) | NAMPTAPPRPS6KA2CACNA1HVNN1 | |
| SCHEMBL20674169 | 0.74 | APP (0.40) | NAMPTAPPRPS6KA2CACNA1HPI4KA | |
| SCHEMBL30478722 | 0.74 | APP (0.40) | NAMPTAPPRPS6KA2CACNA1HPI4KA | |
| SCHEMBL13837838 | 0.74 | APP (0.38) | NAMPTAPPCACNA1HPI4KAPI4K2B | |
| SCHEMBL23178566 | 0.72 | MAOB (0.49) | VNN1ALDH1A1 | |
| SCHEMBL7920028 | 0.72 | CCR1 (0.43) | NAMPTAPPCACNA1HPI4KAPI4K2B | |
| SCHEMBL22554301 | 0.71 | HPGD (0.46) | NAMPTAPPCACNA1HPI4KAPI4K2B | |
| SCHEMBL3303776 | 0.71 | HSD17B10 (0.46) | NAMPTAPPCACNA1HPI4KAPI4K2B | |
| SCHEMBL1980691 | 0.71 | PI4KA (0.43) | NAMPTAPPCACNA1HPI4KAPI4K2B |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024141757-A1 | LSD1 MODULATORS | EXSCIENTIA AI LIMITED (GB) | 2024-07-04 | — | — | WO | disclosed |