Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 1/20 | 0.46 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.46 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.46 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | CNOT7 | Q9UIV1 | 4/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7743868 | 1.00 | PDE4A (0.46) | PDE4APDE4BPDE4CPDE4DTSHR | |
| SCHEMBL7744419 | 0.98 | PDE4A (0.47) | PDE4APDE4BPDE4CPDE4DTSHR | |
| SCHEMBL7744421 | 0.98 | PDE4A (0.47) | PDE4APDE4BPDE4CPDE4DTSHR | |
| SCHEMBL7744408 | 0.91 | ADORA3 (0.48) | PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL7744308 | 0.91 | ADORA3 (0.48) | PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL7744402 | 0.91 | ADORA3 (0.48) | PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL7738383 | 0.88 | PDE4A (0.46) | PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL7738386 | 0.88 | PDE4A (0.46) | PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL7744288 | 0.87 | PDE4A (0.45) | PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL7744291 | 0.87 | PDE4A (0.45) | PDE4APDE4BPDE4CPDE4D |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0708781-B1 | A 3 ADENOSINE RECEPTOR AGONISTS | USA (US) | 2001-10-04 | — | — | EP | disclosed |
| US-5773423-A | XANTHINE RIBOSIDES | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 1998-06-30 | — | — | US | disclosed |
| EP-0708781-A1 | A 3 ADENOSINE RECEPTOR AGONISTS | THE UNITED STATES OF AMERICA, as represented by THE SECRETARY, Department of Health and Human Services (US) | 1996-05-01 | — | — | EP | disclosed |
| WO-1995002604-A1 | A3 ADENOSINE RECEPTOR AGONISTS | THE UNITED STATES OF AMERICA, REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 1995-01-26 | — | — | WO | disclosed |