Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | PDE4A | P27815 | 3/20 | 0.43 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.43 |
| ▸ | PDE4C | Q08493 | 3/20 | 0.43 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.42 |
| ▸ | PDE9A | O76083 | 4/20 | 0.42 |
| ▸ | CCNK | O75909 | 1/20 | 0.41 |
| ▸ | CCND3 | P30281 | 1/20 | 0.41 |
| ▸ | CDK9 | P50750 | 1/20 | 0.41 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.40 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.40 |
| ▸ | STAT3 | P40763 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5970280 | 0.82 | KMT2A (0.46) | L3MBTL1PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL5970424 | 0.82 | ADORA2B (0.40) | PDE4APDE4BPDE4CPDE4DADORA3 | |
| SCHEMBL5970029 | 0.81 | ABL1 (0.43) | PDE4APDE4BPDE4CPDE4DADORA3 | |
| SCHEMBL5970236 | 0.77 | ADORA2B (0.49) | PDE4APDE4BPDE4CPDE4DADORA3 | |
| SCHEMBL5970228 | 0.76 | ADORA2B (0.45) | PDE4APDE4BPDE4CPDE4DADORA3 | |
| SCHEMBL5970321 | 0.72 | ADORA2A (0.47) | PDE4APDE4BPDE4CPDE4DADORA3 | |
| SCHEMBL5971079 | 0.72 | ATM (0.50) | ATML3MBTL1RXFP1PDE9ACCNK | |
| SCHEMBL1108641 | 0.70 | ATM (0.58) | ATML3MBTL1GAAALDH1A1CYP1A2 | |
| SCHEMBL5970475 | 0.68 | ADORA2B (0.49) | PDE4APDE4BPDE4CPDE4DADORA3 | |
| SCHEMBL11562597 | 0.67 | VNN1 (0.58) | ATML3MBTL1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1658291-A2 | SUBSTITUTED 8-HETEROARYL XANTHINES | Adenosine Therapeutics, LLC (US) | 2006-05-24 | — | — | EP | disclosed |
| WO-2005021548-A2 | SUBSTITUTED 8-HETEROARYL XANTHINES | ADENOSINE THERAPEUTICS, LLC (US) | 2005-03-10 | — | — | WO | disclosed |