Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHCY | P23526 | 6/20 | 0.51 |
| ▸ | CA5A | P35218 | 1/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.41 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.41 |
| ▸ | NT5E | P21589 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | CHKA | P35790 | 2/20 | 0.39 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.37 |
| ▸ | DNMT3B | Q9UBC3 | 1/20 | 0.37 |
| ▸ | PI4KA | P42356 | 1/20 | 0.36 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.36 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.36 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.36 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.35 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.35 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL24981046 | 0.81 | RXFP1 (0.56) | AHCYCA5AADORA3ADORA2AADORA2B | |
| SCHEMBL17889873 | 0.79 | RXFP1 (0.41) | AHCYADORA3ADORA2BRXFP1DNMT1 | |
| SCHEMBL1798140 | 0.79 | RXFP1 (0.40) | AHCYADORA2BLMNARXFP1PI4KA | |
| SCHEMBL1794832 | 0.79 | RXFP1 (0.41) | AHCYADORA3ADORA2BRXFP1DNMT1 | |
| SCHEMBL17889824 | 0.79 | RXFP1 (0.40) | AHCYADORA2BLMNARXFP1PI4KA | |
| SCHEMBL31756630 | 0.77 | RXFP1 (0.49) | AHCYADORA2BRXFP1PI4KAPI4K2B | |
| SCHEMBL31756731 | 0.77 | RXFP1 (0.49) | AHCYADORA2BRXFP1PI4KAPI4K2B | |
| SCHEMBL1800335 | 0.76 | RXFP1 (0.38) | AHCYADORA2BRXFP1PI4KAPI4K2B | |
| SCHEMBL17889839 | 0.76 | RXFP1 (0.38) | AHCYADORA2BRXFP1PI4KAPI4K2B | |
| SCHEMBL26534357 | 0.75 | AHCY (0.54) | AHCYADORA2AADORA2BRXFP1PI4KA |
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-2023000708-A1 | POLYSUBSTITUTED PURINE COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 中国药科大学 | 2023-01-26 | — | — | WO | disclosed |