Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 15/20 | 1.00 |
| ▸ | ADORA2A | P29274 | 13/20 | 1.00 |
| ▸ | ADORA3 | P0DMS8 | 5/20 | 0.80 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.80 |
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 | |
|---|---|---|---|---|
| SCHEMBL7222971 | 0.91 | ADORA2B (1.00) | ADORA2BADORA2AADORA3ADORA1 | |
| SCHEMBL7235224 | 0.89 | ADORA2B (1.00) | ADORA2BADORA2AADORA3ADORA1 | |
| SCHEMBL10723862 | 0.86 | ADORA2B (1.00) | ADORA2BADORA2AADORA3ADORA1 | |
| SCHEMBL7226513 | 0.85 | ADORA2B (0.79) | ADORA2BADORA2AADORA3ADORA1 | |
| Aminomethylamide SCHEMBL9596537 | 0.83 | ADORA2A (0.89) | ADORA2BADORA2AADORA3ADORA1 | |
| SCHEMBL7316494 | 0.83 | ADORA2B (0.76) | ADORA2BADORA2AADORA3ADORA1 | |
| SCHEMBL7222198 | 0.83 | ADORA2B (1.00) | ADORA2BADORA2AADORA3ADORA1 | |
| SCHEMBL7228029 | 0.82 | ADORA2B (1.00) | ADORA2BADORA2AADORA3ADORA1 | |
| SCHEMBL10816548 | 0.82 | ADORA2B (0.69) | ADORA2BADORA2AADORA3ADORA1 | |
| SCHEMBL9164820 | 0.82 | ADORA2B (0.80) | ADORA2BADORA2AADORA3ADORA1 |
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 6 patents. 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 |
| US-4696932-A | ANTIALLERGENS, ANTIHISTAMINES, CARDIOTONIC AGENTS | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 1987-09-29 | — | — | US | disclosed |
| EP-0198921-A4 | BIOLOGICALLY-ACTIVE XANTHINE DERIVATIVES. | US COMMERCE (US) | 1987-03-16 | — | — | EP | disclosed |
| EP-0198921-A1 | BIOLOGICALLY-ACTIVE XANTHINE DERIVATIVES | THE UNITED STATES OF AMERICA as represented by the Secretary UNITED STATES DEPARTMENT OF COMMERCE (US) | 1986-10-29 | — | — | EP | disclosed |
| US-4612315-A | Biologically-active 1,3-dipropyl-8-phenylxanthine derivatives | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 1986-09-16 | — | — | US | disclosed |
| WO-1986002551-A1 | BIOLOGICALLY-ACTIVE XANTHINE DERIVATIVES | UNITED STATES OF AMERICA, REPRESENTED BY THE UNITE (US) | 1986-05-09 | — | — | WO | disclosed |