Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 3/20 | 0.47 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.47 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8830649 | 0.91 | ADORA2A (0.47) | ADORA2AADORA2BADORA1KDM4ECYP1A2 | |
| SCHEMBL8830564 | 0.91 | ADORA2B (0.53) | ADORA2AADORA2BADORA1KDM4ECYP1A2 | |
| SCHEMBL8830571 | 0.89 | ADORA2B (0.56) | ADORA2AADORA2BADORA1KDM4ECYP1A2 | |
| SCHEMBL8830674 | 0.84 | PTGS1 (0.40) | ADORA2AADORA2B | |
| SCHEMBL9568729 | 0.84 | ADORA2A (0.63) | ADORA2AADORA2BADORA1KDM4ECYP1A2 | |
| SCHEMBL8830551 | 0.81 | ADORA2B (0.44) | ADORA2AADORA2BADORA1KDM4ECYP1A2 | |
| SCHEMBL8830756 | 0.78 | ADORA2B (0.57) | ADORA2AADORA2BADORA1KDM4ECYP1A2 | |
| SCHEMBL8830607 | 0.76 | ADORA2B (0.58) | ADORA2AADORA2BADORA1KDM4ECYP1A2 | |
| SCHEMBL8830647 | 0.75 | PTGS1 (0.39) | ADORA2AADORA2B | |
| SCHEMBL8830563 | 0.74 | PTGS1 (0.40) | ADORA2AADORA2BADORA1KDM4ECYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5661153-A | FOR TREATING ALLERGIES, ASTHMA, DERMATITIS, GRAFT REJECTIONS | JAPAN ENERGY CORPORATION (JP) | 1997-08-26 | — | — | US | disclosed |
| EP-0700908-A1 | 1-Arylpyrimidine derivatives and pharmaceutical use thereof | JAPAN ENERGY CORPORATION (JP) | 1996-03-13 | — | — | EP | disclosed |