Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.62 |
| ▸ | FGFR1 | P11362 | 9/20 | 0.59 |
| ▸ | FGFR4 | P22455 | 9/20 | 0.59 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.49 |
| ▸ | FDPS | P14324 | 1/20 | 0.48 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.48 |
| ▸ | PI4KA | P42356 | 1/20 | 0.48 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.48 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.48 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL22533476 | 1.00 | HDAC6 (0.62) | HDAC6FGFR1FGFR4P2RX7FDPS | |
| SCHEMBL22084386 | 0.85 | ADORA2A (0.47) | HDAC6FGFR1FGFR4ADORA2API4KA | |
| SCHEMBL29424732 | 0.85 | ADORA2A (0.68) | ADORA2API4KAPI4K2BPI4K2API4KB | |
| SCHEMBL22533785 | 0.85 | ADORA2A (0.68) | ADORA2API4KAPI4K2BPI4K2API4KB | |
| SCHEMBL22533420 | 0.82 | HPGD (0.56) | HDAC6FGFR1FGFR4ADORA2API4KA | |
| SCHEMBL29424867 | 0.82 | HPGD (0.56) | HDAC6FGFR1FGFR4ADORA2API4KA | |
| SCHEMBL5453774 | 0.81 | HDAC6 (0.62) | HDAC6FGFR1FGFR4P2RX7ADORA2A | |
| SCHEMBL6659705 | 0.81 | HDAC6 (0.62) | HDAC6FGFR1FGFR4P2RX7ADORA2A | |
| SCHEMBL30984022 | 0.81 | ADORA2A (0.70) | HDAC6FGFR1FGFR4ADORA2API4KA | |
| SCHEMBL2980291 | 0.81 | ADORA2A (0.70) | HDAC6FGFR1FGFR4ADORA2API4KA |
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-114040915-A | Bicyclic heteroaryl derivatives as ectonucleotide pyrophosphatase phosphodiesterase 1 inhibitors | 里伯赛恩斯有限责任公司 | 2022-02-11 | — | — | CN | disclosed |