Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 9/20 | 0.44 |
| ▸ | PDE4B | Q07343 | 9/20 | 0.44 |
| ▸ | PDE4C | Q08493 | 9/20 | 0.44 |
| ▸ | PDE4D | Q08499 | 9/20 | 0.44 |
| ▸ | MPO | P05164 | 3/20 | 0.42 |
| ▸ | TPO | P07202 | 3/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.40 |
| ▸ | PNP | P00491 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | MGLL | Q99685 | 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 | |
|---|---|---|---|---|
| SCHEMBL4457135 | 0.93 | MPO (0.47) | PDE4APDE4BPDE4CPDE4DMPO | |
| SCHEMBL4488530 | 0.87 | MGLL (0.48) | HPGDHSD17B10MGLLPOLB | |
| SCHEMBL4457887 | 0.82 | PDE4B (0.39) | PDE4APDE4BPDE4CPDE4DMPO | |
| SCHEMBL4461189 | 0.79 | MPO (0.44) | PDE4APDE4BPDE4CPDE4DMPO | |
| SCHEMBL4453729 | 0.78 | NPC1 (0.47) | PDE4APDE4BPDE4CPDE4DMPO | |
| SCHEMBL4455014 | 0.77 | PDE4A (0.54) | PDE4APDE4BPDE4CPDE4DMPO | |
| SCHEMBL4460714 | 0.76 | MPO (0.53) | PDE4APDE4BPDE4CPDE4DMPO | |
| SCHEMBL4454521 | 0.74 | MGLL (0.44) | KMT2AHPGDBLMMGLLPOLB | |
| SCHEMBL4456850 | 0.74 | MPO (0.43) | PDE4APDE4BPDE4CPDE4DMPO | |
| SCHEMBL4456420 | 0.73 | MPO (0.42) | PDE4APDE4BPDE4CPDE4DMPO |
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 |
|---|---|---|---|---|---|---|---|
| EP-2010534-A1 | THIOXANTHINE DERIVATIVES AND THEIR USE AS INHIBITORS OF MPO | AstraZeneca AB (SE) | 2009-01-07 | — | — | EP | disclosed |
| WO-2007120097-A1 | THIOXANTHINE DERIVATIVES AND THEIR USE AS INHIBITORS OF MPO | ASTRAZENECA AB (SE) | 2007-10-25 | — | — | WO | disclosed |