Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 2/20 | 0.53 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.53 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL7728787 | 1.00 | ADORA2A (0.53) | ADORA2AADORA3ADORA2B | |
| SCHEMBL7722409 | 0.91 | ADORA2A (0.64) | ADORA2AADORA3ADORA2B | |
| SCHEMBL7722412 | 0.91 | ADORA2A (0.64) | ADORA2AADORA3ADORA2B | |
| SCHEMBL7543951 | 0.86 | ADORA2A (0.55) | ADORA2AADORA3ADORA2B | |
| SCHEMBL7543947 | 0.86 | ADORA2A (0.55) | ADORA2AADORA3ADORA2B | |
| SCHEMBL7310635 | 0.84 | ADORA2A (0.62) | ADORA2AADORA3ADORA2B | |
| SCHEMBL30632570 | 0.84 | ADORA2A (0.62) | ADORA2AADORA3ADORA2B | |
| SCHEMBL7310644 | 0.84 | ADORA2A (0.62) | ADORA2AADORA3ADORA2B | |
| SCHEMBL7280362 | 0.82 | ADORA2A (0.53) | ADORA2A | |
| SCHEMBL7280368 | 0.82 | ADORA2A (0.53) | ADORA2A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0628311-B1 | Xanthine-Derivatives as Antidepressants | KYOWA HAKKO KOGYO KK (JP) | 2002-04-24 | — | — | EP | disclosed |
| US-5587378-A | ADMINISTERING A SUBSTITUTED XANTHINE COMPOUND | KYOWA HAKKO KOGYO CO., LTD. (JP) | 1996-12-24 | — | — | US | disclosed |
| US-5543415-A | ADMINISTERING A XANTHINE DERIVATIVE | KYOWA HAKKO KOGYO CO., LTD. (JP) | 1996-08-06 | — | — | US | disclosed |
| US-5484920-A | XANTHINE DERIVATIVES | KYOWA HAKKO KOGYO CO., LTD. (JP) | 1996-01-16 | — | — | US | disclosed |
| EP-0628311-A1 | ANTIDEPRESSANT | KYOWA HAKKO KOGYO CO., LTD. (JP) | 1994-12-14 | — | — | EP | disclosed |