Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.41 |
| ▸ | PDCD1LG2 | Q9BQ51 | 1/20 | 0.40 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.40 |
| ▸ | NAMPT | P43490 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.34 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.34 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.33 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL13123169 | 0.82 | CYP2C9 (0.40) | CYP2C9EPHX2MAP4K4PDCD1LG2CD274 | |
| SCHEMBL19087064 | 0.82 | PDCD1LG2 (0.41) | CYP2C9EPHX2MAP4K4PDCD1LG2CD274 | |
| SCHEMBL7920351 | 0.82 | PDCD1LG2 (0.41) | CYP2C9EPHX2MAP4K4PDCD1LG2CD274 | |
| SCHEMBL19116698 | 0.80 | CD274 (0.47) | CYP2C9EPHX2MAP4K4PDCD1LG2CD274 | |
| SCHEMBL19077886 | 0.78 | CYP2C9 (0.41) | CYP2C9EPHX2MAP4K4PDCD1LG2CD274 | |
| SCHEMBL6232040 | 0.78 | KDM4E (0.38) | CYP2C9EPHX2MAP4K4PDCD1LG2CD274 | |
| SCHEMBL28262276 | 0.78 | MAP4K4 (0.39) | CYP2C9EPHX2MAP4K4PDCD1LG2CD274 | |
| SCHEMBL14250161 | 0.78 | — | — | |
| SCHEMBL30339210 | 0.78 | — | — | |
| SCHEMBL12090384 | 0.76 | MAP4K4 (0.46) | CYP2C9EPHX2MAP4K4CHRM2CHRM1 |
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-105622526-A | Preparation method of 2-aminopyrazine derivatives | UNIV HUBEI TECHNOLOGY | 2016-06-01 | — | — | CN | claimed |
| CN-105622526-A | Preparation method of 2-aminopyrazine derivatives | UNIV HUBEI TECHNOLOGY | 2016-06-01 | — | — | CN | disclosed |