Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 1/20 | 0.46 |
| ▸ | CHUK | O15111 | 1/20 | 0.41 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.35 |
| ▸ | ILK | Q13418 | 1/20 | 0.35 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.33 |
| ▸ | PDE4A | P27815 | 1/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.33 |
| ▸ | NOS3 | P29474 | 1/20 | 0.32 |
| ▸ | NOS1 | P29475 | 1/20 | 0.32 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.31 |
| ▸ | TRIM58 | Q8NG06 | 1/20 | 0.31 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL23514151 | 0.91 | KCNH2 (0.43) | APPCHUKKCNH2ILK | |
| SCHEMBL29653649 | 0.91 | KCNH2 (0.43) | APPCHUKKCNH2ILK | |
| SCHEMBL23500595 | 0.83 | APP (0.33) | APPKCNH2 | |
| SCHEMBL23513867 | 0.78 | APP (0.50) | APPTLR7 | |
| SCHEMBL29653626 | 0.78 | APP (0.50) | APPTLR7 | |
| SCHEMBL23514071 | 0.77 | KCNH2 (0.47) | APPCHUKCHRM4KCNH2HRH4 | |
| SCHEMBL23500421 | 0.76 | ILK (0.40) | APPKCNH2ILKTLR7CYP2C9 | |
| SCHEMBL23500158 | 0.75 | NPC1 (0.40) | APPHRH4TLR7 | |
| SCHEMBL23514158 | 0.75 | TLR7 (0.45) | APPILKTLR7 | |
| SCHEMBL23500558 | 0.75 | NPC1 (0.40) | APPHRH4TLR7 |
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-2021114691-A1 | NITROGEN-CONTAINING RING-FUSED COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF | 四川科伦博泰生物医药股份有限公司 | 2021-06-17 | — | — | WO | disclosed |