Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARG | Q86W56 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | MITF | O75030 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | GNRHR | P30968 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | PDE4A | P27815 | 4/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 4/20 | 0.36 |
| ▸ | PDE4C | Q08493 | 4/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 4/20 | 0.36 |
| ▸ | CFTR | P13569 | 1/20 | 0.36 |
| ▸ | PDE5A | O76074 | 3/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4767817 | 0.89 | PARG (0.38) | PARGALDH1A1MAPTHTTNPC1 | |
| SCHEMBL4765596 | 0.81 | ALDH1A1 (0.40) | PARGALDH1A1MAPTHTTNPC1 | |
| SCHEMBL4762497 | 0.81 | ALDH1A1 (0.43) | ALDH1A1MAPTHTTNPC1MITF | |
| SCHEMBL4771453 | 0.77 | ADORA3 (0.44) | ALDH1A1MAPTHTTNPC1MITF | |
| SCHEMBL4767961 | 0.77 | PDE4D (0.38) | LMNANPSR1GNRHRPDE4APDE4B | |
| SCHEMBL4771274 | 0.77 | PDE5A (0.46) | GNRHRPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL4057548 | 0.75 | ALDH1A1 (0.44) | ALDH1A1MAPTHTTNPC1MITF | |
| SCHEMBL4767937 | 0.75 | PDE4A (0.46) | HTTKMT2AGNRHRPDE4APDE4B | |
| SCHEMBL4765718 | 0.75 | PDE4D (0.46) | LMNANPSR1KMT2AGNRHRPDE4A | |
| SCHEMBL4769379 | 0.75 | ALDH1A1 (0.42) | PARGALDH1A1MAPTLMNAKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1678181-B1 | A2B ADENOSINE RECEPTOR ANTAGONISTS | CV THERAPEUTICS INC (US) | 2008-12-31 | — | — | EP | disclosed |