Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 3/20 | 0.49 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL6999142 | 0.83 | SIRT1 (0.46) | ADORA2AADORA2BKDM4EMEN1ALDH1A1 | |
| SCHEMBL7661252 | 0.82 | ADORA1 (0.47) | ADORA2AADORA2BKDM4EMEN1ALDH1A1 | |
| SCHEMBL7656833 | 0.81 | KMT2A (0.50) | ADORA2AADORA2BKDM4EMEN1ALDH1A1 | |
| SCHEMBL7657404 | 0.81 | TSHR (0.46) | ADORA2AADORA2BKDM4EMEN1ALDH1A1 | |
| SCHEMBL7670431 | 0.77 | ADORA2B (0.54) | ADORA2AADORA2BKDM4EMEN1ALDH1A1 | |
| SCHEMBL8560750 | 0.76 | PDE4A (0.52) | ADORA2AADORA2BHSD17B10ADORA3 | |
| SCHEMBL6995974 | 0.76 | MEN1 (0.49) | ADORA2AADORA2BMEN1CYP1A2CYP3A4 | |
| SCHEMBL8560002 | 0.75 | ADORA1 (0.58) | ADORA2AADORA2BKDM4EMEN1ALDH1A1 | |
| SCHEMBL7659412 | 0.74 | ADORA2B (0.45) | ADORA2AADORA2BKDM4EMEN1ALDH1A1 | |
| SCHEMBL7668670 | 0.73 | ADORA2B (0.51) | ADORA2AADORA2BKDM4EMEN1ALDH1A1 |
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-1087973-B1 | IMIDAZOTRIAZOLOPYRIMIDINES USED AS A DRUG HAVING AN ADENOSINE ANTAGONIST ACTIVITY | BOEHRINGER INGELHEIM PHARMA (DE) | 2003-01-08 | — | — | EP | claimed |
| EP-1087973-A1 | IMIDAZOTRIAZOLOPYRIMIDINES USED AS A DRUG HAVING AN ADENOSINE ANTAGONIST ACTIVITY | Boehringer Ingelheim Pharma KG (DE) | 2001-04-04 | — | — | EP | claimed |
| WO-1999065912-A1 | IMIDAZOTRIAZOLOPYRIMIDINES USED AS A DRUG HAVING AN ADENOSINE ANTAGONIST ACTIVITY | BOEHRINGER INGELHEIM PHARMA KG (DE) | 1999-12-23 | — | — | WO | claimed |