Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHCY | P23526 | 8/20 | 0.45 |
| ▸ | ADORA2A | P29274 | 5/20 | 0.44 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.44 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.44 |
| ▸ | PI4KA | P42356 | 2/20 | 0.43 |
| ▸ | PI4K2B | Q8TCG2 | 2/20 | 0.43 |
| ▸ | PI4K2A | Q9BTU6 | 2/20 | 0.43 |
| ▸ | PI4KB | Q9UBF8 | 2/20 | 0.43 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL16485904 | 0.88 | GSK3B (0.48) | AHCYADORA2AADORA1PI4KAPI4K2B | |
| SCHEMBL28145519 | 0.78 | ADORA2A (0.50) | AHCYADORA2AADORA1ADORA2BPI4KA | |
| SCHEMBL4298072 | 0.76 | ADORA2A (0.56) | AHCYADORA2AADORA1ADORA2BPI4KA | |
| SCHEMBL28113155 | 0.74 | GSK3B (0.51) | AHCYADORA2AADORA1ADORA2BPI4KA | |
| SCHEMBL15297006 | 0.72 | ADCY5 (0.47) | AHCYADORA2AADORA1ADORA2BPI4KA | |
| SCHEMBL1577868 | 0.71 | ADORA2A (0.46) | AHCYADORA2AADORA1ADORA2BPI4KA | |
| SCHEMBL23834271 | 0.70 | ADORA2A (0.58) | AHCYADORA2AADORA1ADORA2BPI4KA | |
| SCHEMBL28086747 | 0.70 | ADORA2A (0.48) | AHCYADORA2AADORA1ADORA2BPI4KA | |
| SCHEMBL9663409 | 0.69 | MARS1 (0.58) | AHCYADORA2AADORA1GSK3BALDH1A1 | |
| SCHEMBL27157939 | 0.68 | AHCY (0.55) | AHCYADORA2AADORA1ADORA2BPI4KA |
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-110146639-A | A kind of analysis method of the novel nucleoside acids reverse transcriptase inhibitor in relation to substance | 南京正大天晴制药有限公司 | 2019-08-20 | — | — | CN | claimed |
| CN-110146639-A | A kind of analysis method of the novel nucleoside acids reverse transcriptase inhibitor in relation to substance | 南京正大天晴制药有限公司 | 2019-08-20 | — | — | CN | disclosed |