Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 5/20 | 0.40 |
| ▸ | ADORA2B | P29275 | 5/20 | 0.40 |
| ▸ | PDE4A | P27815 | 3/20 | 0.40 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.40 |
| ▸ | PDE4C | Q08493 | 3/20 | 0.40 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 5/20 | 0.38 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.38 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.38 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | BLM | P54132 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | GMNN | O75496 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL21891275 | 0.69 | ALDH1A1 (0.33) | ADORA2AADORA2BPDE4APDE4BPDE4C | |
| SCHEMBL8443038 | 0.67 | POLB (0.39) | ADORA2AADORA2BPDE4APDE4BPDE4C | |
| SCHEMBL331903 | 0.66 | PDE4A (0.47) | ADORA2AADORA2BPDE4APDE4BPDE4C | |
| SCHEMBL16060128 | 0.63 | ADORA2B (0.37) | ADORA2AADORA2BPDE4APDE4BPDE4C | |
| SCHEMBL17935736 | 0.61 | APEX1 (0.54) | ADORA2AADORA2BPDE4APDE4BPDE4C | |
| SCHEMBL2462138 | 0.60 | KDM4E (0.40) | MEN1LMNAKMT2A | |
| SCHEMBL23020227 | 0.60 | GSK3A (0.50) | ADORA2AADORA2BPDE4APDE4BPDE4C | |
| SCHEMBL21974369 | 0.60 | GSK3A (0.50) | ADORA2AADORA2BPDE4APDE4BPDE4C | |
| SCHEMBL13108310 | 0.60 | PDE4A (0.48) | ADORA2AADORA2BPDE4APDE4BPDE4C | |
| SCHEMBL1061386 | 0.60 | ALDH1A1 (0.51) | ADORA2AADORA2BPDE4APDE4BPDE4C |
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-2268641-A2 | HETEROCYCLIC COMPOUNDS AS ADENOSINE RECEPTOR ANTAGONIST | Advinus Therapeutics Pvt. Ltd. (IN) | 2011-01-05 | — | — | EP | claimed |
| WO-2009118759-A2 | HETEROCYCLIC COMPOUNDS AS ADENOSINE RECEPTOR ANTAGONIST | ADVINUS THERAPEUTICS PVT. LTD., (IN) | 2009-10-01 | — | — | WO | claimed |