Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GLS | O94925 | 2/20 | 0.41 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.38 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.38 |
| ▸ | AR | P10275 | 1/20 | 0.37 |
| ▸ | KDM1A | O60341 | 2/20 | 0.36 |
| ▸ | AHR | P35869 | 1/20 | 0.35 |
| ▸ | PNMT | P11086 | 4/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.35 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4387750 | 0.83 | PNMT (0.45) | GLSPBRM1CA2HRH3HRH4 | |
| SCHEMBL6621837 | 0.83 | PNMT (0.47) | GLSPBRM1CA2HRH3HRH4 | |
| SCHEMBL13862128 | 0.82 | GLS (0.39) | GLSPBRM1CA2HRH3HRH4 | |
| SCHEMBL8038096 | 0.80 | CA2 (0.38) | GLSPBRM1CA2HRH3HRH4 | |
| SCHEMBL8250882 | 0.79 | HRH3 (0.43) | GLSPBRM1CA2HRH3HRH4 | |
| SCHEMBL10368729 | 0.78 | HRH3 (0.41) | HRH3ARAHRADRA2AADRA2B | |
| SCHEMBL28017915 | 0.78 | SIRT2 (0.42) | GLSPBRM1HRH3HRH4PNMT | |
| SCHEMBL23564246 | 0.75 | HRH3 (0.40) | GLSPBRM1CA2HRH3HRH4 | |
| SCHEMBL8690822 | 0.75 | SIRT2 (0.46) | GLS | |
| SCHEMBL9935891 | 0.74 | HRH3 (0.49) | CA2HRH3ADRA2AADRA2BADRA2C |
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-114929342-A | Pyrazolyl derivatives as anticancer agents | 诺华股份有限公司 | 2022-08-19 | — | — | CN | disclosed |