Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 12/20 | 0.49 |
| ▸ | PDE4B | Q07343 | 12/20 | 0.49 |
| ▸ | PDE4C | Q08493 | 12/20 | 0.49 |
| ▸ | PDE4D | Q08499 | 12/20 | 0.49 |
| ▸ | ADORA2A | P29274 | 9/20 | 0.49 |
| ▸ | ADORA2B | P29275 | 4/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | BLM | P54132 | 1/20 | 0.49 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | PDE1A | P54750 | 1/20 | 0.44 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.44 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.44 |
| ▸ | TNF | P01375 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9287682 | 0.78 | ADORA2A (0.56) | PDE4APDE4BPDE4CPDE4DADORA2A | |
| SCHEMBL4120049 | 0.77 | ADORA2A (0.54) | PDE4APDE4BPDE4CPDE4DADORA2A | |
| SCHEMBL7162120 | 0.76 | ADORA2A (0.47) | PDE4APDE4BPDE4CPDE4DADORA2A | |
| SCHEMBL3171115 | 0.75 | ADORA2A (0.55) | PDE4APDE4BPDE4CPDE4DADORA2A | |
| SCHEMBL7269369 | 0.72 | ADORA1 (0.45) | PDE4APDE4BPDE4CPDE4DADORA2A | |
| SCHEMBL3272841 | 0.71 | LMNA (0.54) | ADORA2AADORA2BHSD17B10 | |
| SCHEMBL8710809 | 0.70 | ADORA3 (0.39) | ADORA2A | |
| SCHEMBL27304624 | 0.68 | ADORA2B (0.56) | ADORA2AADORA2BCYP1A2CYP3A4HSD17B10 | |
| SCHEMBL13111704 | 0.67 | NPC1 (0.56) | PDE4APDE4BPDE4CPDE4DADORA2A | |
| SCHEMBL4983107 | 0.67 | PDE4A (0.60) | PDE4APDE4BPDE4CPDE4DADORA2A |
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 |
|---|---|---|---|---|---|---|---|
| US-4968672-A | DRUG DELIVERY; DIURETICS, KIDNEY DISORDERS, HYPOTENSIVE AGENTS | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 1990-11-06 | — | — | US | disclosed |