Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 17/20 | 1.00 |
| ▸ | ADORA2A | P29274 | 10/20 | 1.00 |
| ▸ | ADORA3 | P0DMS8 | 7/20 | 1.00 |
| ▸ | ADORA1 | P30542 | 5/20 | 1.00 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.68 |
| ▸ | MEN1 | O00255 | 2/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.68 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.68 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.68 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.68 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.68 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.68 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.68 |
| ▸ | GLA | P06280 | 1/20 | 0.64 |
| ▸ | HPGD | P15428 | 1/20 | 0.64 |
| ▸ | TSHR | P16473 | 1/20 | 0.64 |
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 | |
|---|---|---|---|---|
| SCHEMBL30741228 | 1.00 | ADORA2B (1.00) | ADORA2BADORA2AADORA3ADORA1KDM4E | |
| SCHEMBL27841466 | 0.94 | ADORA2B (0.88) | ADORA2BADORA2AADORA3ADORA1KDM4E | |
| SCHEMBL27841496 | 0.89 | ADORA2B (0.80) | ADORA2BADORA2AADORA3ADORA1KDM4E | |
| SCHEMBL27859100 | 0.85 | ADORA2B (0.74) | ADORA2BADORA2AADORA3ADORA1KDM4E | |
| SCHEMBL6555024 | 0.84 | ADORA2B (0.73) | ADORA2BADORA2AADORA3ADORA1KDM4E | |
| SCHEMBL6555021 | 0.84 | ADORA2B (0.73) | ADORA2BADORA2AADORA3ADORA1KDM4E | |
| SCHEMBL7222964 | 0.83 | ADORA2B (1.00) | ADORA2BADORA2AADORA3ADORA1KDM4E | |
| SCHEMBL7222961 | 0.83 | ADORA2B (1.00) | ADORA2BADORA2AADORA3ADORA1KDM4E | |
| SCHEMBL27859192 | 0.82 | ADORA2B (0.70) | ADORA2BADORA2AADORA3ADORA1KDM4E | |
| SCHEMBL1948455 | 0.82 | ADORA2B (1.00) | ADORA2BADORA2AADORA3ADORA1KDM4E |
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 3 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 |
| 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 |