Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 4/20 | 0.62 |
| ▸ | ADORA2B | P29275 | 7/20 | 0.61 |
| ▸ | ADORA2A | P29274 | 6/20 | 0.61 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | GMNN | O75496 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | DRD1 | P21728 | 1/20 | 0.43 |
| ▸ | DRD5 | P21918 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8579784 | 0.83 | ADORA1 (0.65) | ADORA1ADORA2BADORA2AADORA3KMT2A | |
| SCHEMBL8355232 | 0.79 | ADORA3 (0.65) | ADORA1ADORA2BADORA2AADORA3KMT2A | |
| SCHEMBL8575318 | 0.79 | ADORA1 (0.65) | ADORA1ADORA2BADORA2AADORA3KMT2A | |
| SCHEMBL8020381 | 0.79 | ADORA2B (0.68) | ADORA1ADORA2BADORA2AADORA3KMT2A | |
| SCHEMBL8118476 | 0.77 | ADORA1 (1.00) | ADORA1ADORA2BADORA2AADORA3KMT2A | |
| SCHEMBL8579120 | 0.76 | ADORA1 (0.64) | ADORA1ADORA2BADORA2AADORA3KMT2A | |
| SCHEMBL5229734 | 0.76 | ADORA2B (1.00) | ADORA1ADORA2BADORA2AADORA3KMT2A | |
| SCHEMBL9645551 | 0.75 | ADORA1 (0.95) | ADORA1ADORA2BADORA2AADORA3KMT2A | |
| SCHEMBL8580800 | 0.74 | ADORA1 (0.76) | ADORA1ADORA2BADORA2AADORA3KMT2A | |
| SCHEMBL8579881 | 0.73 | ADORA1 (0.62) | ADORA1ADORA2BADORA2AADORA3KMT2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0654033-A1 | ASYMMETRICALLY SUBSTITUTED XANTHINE WITH ADENOSINE-ANTAGONISTIC PROPERTIES | BOEHRINGER INGELHEIM KG (DE) | 1995-05-24 | — | — | EP | disclosed |