Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRK6 | P43250 | 1/20 | 0.39 |
| ▸ | PDE5A | O76074 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 3/20 | 0.33 |
| ▸ | DRD2 | P14416 | 3/20 | 0.33 |
| ▸ | HTR2A | P28223 | 3/20 | 0.33 |
| ▸ | HTR7 | P34969 | 3/20 | 0.33 |
| ▸ | HTR6 | P50406 | 3/20 | 0.33 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.33 |
| ▸ | HRH1 | P35367 | 1/20 | 0.33 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.33 |
| ▸ | IP6K1 | Q92551 | 1/20 | 0.33 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.33 |
| ▸ | GBA1 | P04062 | 1/20 | 0.33 |
| ▸ | BRS3 | P32247 | 1/20 | 0.32 |
| ▸ | PDE4A | P27815 | 1/20 | 0.32 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.32 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.32 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL2813041 | 0.92 | HTR1A (0.40) | GRK6HTR1ADRD2HTR2AHTR7 | |
| SCHEMBL2813847 | 0.90 | PDE5A (0.43) | GRK6PDE5A | |
| SCHEMBL2814442 | 0.84 | CLPP (0.39) | HRH1HRH4BRS3 | |
| SCHEMBL2814261 | 0.83 | CLPP (0.39) | HRH1HRH4 | |
| SCHEMBL2811109 | 0.82 | SIGMAR1 (0.43) | GRK6 | |
| SCHEMBL2810268 | 0.82 | CLPP (0.42) | HRH1HRH4GAA | |
| SCHEMBL2813934 | 0.82 | CLPP (0.42) | HRH1HRH4GAA | |
| SCHEMBL2816451 | 0.82 | CLPP (0.39) | GRK6HRH1HRH4BRS3GAA | |
| SCHEMBL2813023 | 0.81 | CLPP (0.38) | GRK6ADAMTS4HRH1HRH4GAA | |
| SCHEMBL537893 | 0.81 | ALDH1A1 (0.40) | BRS3 |
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-2010114905-A1 | PERI-FUSED PYRAZOLO-PYRIMIDINE COMPOUNDS | ARQULE, INC. (US) | 2010-10-07 | — | — | WO | disclosed |