Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
| ▸ | HRH4 | Q9H3N8 | 4/20 | 0.41 |
| ▸ | HRH1 | P35367 | 3/20 | 0.41 |
| ▸ | PDE4A | P27815 | 4/20 | 0.41 |
| ▸ | PDE4B | Q07343 | 4/20 | 0.41 |
| ▸ | PDE4C | Q08493 | 4/20 | 0.41 |
| ▸ | PDE4D | Q08499 | 4/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.39 |
| ▸ | F2 | P00734 | 2/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | TLR9 | Q9NR96 | 3/20 | 0.39 |
| ▸ | TLR7 | Q9NYK1 | 3/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3704626 | 0.90 | HRH4 (0.52) | ACHEHRH4HRH1PDE4APDE4B | |
| SCHEMBL3788257 | 0.88 | TLR9 (0.44) | ACHEHRH4HRH1PDE4APDE4B | |
| SCHEMBL3786031 | 0.86 | CNR2 (0.42) | HRH4HRH1HSD17B10KMT2ATLR9 | |
| SCHEMBL3779641 | 0.86 | HTT (0.50) | ACHEPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL3785003 | 0.86 | PDE4A (0.47) | ACHEHRH4HRH1PDE4APDE4B | |
| SCHEMBL3784610 | 0.85 | PDE4A (0.50) | ACHEHRH4HRH1PDE4APDE4B | |
| SCHEMBL3784136 | 0.85 | PDE4A (0.44) | HRH4HRH1PDE4APDE4BPDE4C | |
| SCHEMBL3781010 | 0.84 | HRH4 (0.52) | HRH4HRH1PDE4APDE4BPDE4C | |
| SCHEMBL3786948 | 0.84 | PDE4A (0.43) | HRH4HRH1PDE4APDE4BPDE4C | |
| SCHEMBL3783454 | 0.83 | ACHE (0.47) | ACHEHRH4HRH1PDE4APDE4B |
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-2010083645-A1 | PYRIMIDO[5,4-e][1,2,4]TRIAZINES AND USES THEREOF | SHANGHAI TARGETDRUG CO., LTD (CN) | 2010-07-29 | — | — | WO | disclosed |