Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 2/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.51 |
| ▸ | HPGD | P15428 | 4/20 | 0.51 |
| ▸ | PKM | P14618 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | HTT | P42858 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | GLA | P06280 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | ERCC1 | P07992 | 6/20 | 0.48 |
| ▸ | FEN1 | P39748 | 6/20 | 0.48 |
| ▸ | ERCC4 | Q92889 | 6/20 | 0.48 |
| ▸ | TYMP | P19971 | 1/20 | 0.48 |
| ▸ | DNASE1 | P24855 | 1/20 | 0.47 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.46 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL378879 | 0.74 | ADORA2B (1.00) | ADORA2BHPGDALDH1A1KMT2AMEN1 | |
| SCHEMBL6783434 | 0.71 | GRIA1 (0.59) | ADORA2BKDM4EHPGDPKMALDH1A1 | |
| SCHEMBL18036538 | 0.70 | ADORA2B (0.63) | ADORA2BKDM4EHPGDPKMALDH1A1 | |
| SCHEMBL4400471 | 0.70 | HPGD (0.51) | KDM4EHPGDPKMALDH1A1GAA | |
| SCHEMBL23607984 | 0.69 | ADORA2B (0.71) | ADORA2BKDM4EHPGDALDH1A1MAPK1 | |
| SCHEMBL4927186 | 0.69 | ADORA2B (0.70) | ADORA2BKDM4EHPGDALDH1A1KMT2A | |
| SCHEMBL11830857 | 0.68 | HPGD (1.00) | KDM4EHPGDPKMALDH1A1MAPK1 | |
| SCHEMBL30362164 | 0.68 | HPGD (1.00) | KDM4EHPGDPKMALDH1A1MAPK1 | |
| SCHEMBL42351 | 0.68 | NOS1 (0.55) | ADORA2BKDM4EHPGDPKMALDH1A1 | |
| SCHEMBL1051055 | 0.68 | ADORA2B (0.60) | ADORA2BKDM4EHPGDALDH1A1MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103254194-B | Preparation method of 8-thiaxanthine compound | UNIV ZHEJIANG NORMAL | 2015-07-08 | — | — | CN | disclosed |
| CN-103275079-B | Preparation method for 8-aryl or vinyl-substituted xanthine compound | UNIV ZHEJIANG NORMAL | 2015-06-24 | — | — | CN | disclosed |
| CN-103275079-A | Preparation method for 8-aryl or vinyl-substituted xanthine compound | UNIV ZHEJIANG NORMAL | 2013-09-04 | — | — | CN | disclosed |
| CN-103254194-A | Preparation method of 8-thiaxanthine compound | UNIV ZHEJIANG NORMAL | 2013-08-21 | — | — | CN | disclosed |
| US-5453426-A | Sulfur-containing xanthine derivatives as adenosine antagonists | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 1995-09-26 | — | — | US | disclosed |
| WO-1990012797-A1 | SULFER-CONTAINING XANTHINE DERIVATIVES AS ADENOSIN ANTAGONISTS | THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, U.S. DEPARTMENT OF COMMERCE (US) | 1990-11-01 | — | — | WO | disclosed |