Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 7/20 | 0.59 |
| ▸ | AHCY | P23526 | 7/20 | 0.59 |
| ▸ | ADORA1 | P30542 | 5/20 | 0.56 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.56 |
| ▸ | PDE8B | O95263 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8357822 | 1.00 | ADORA2A (0.59) | ADORA2AAHCYADORA1ADORA2BPDE8B | |
| SCHEMBL8910624 | 0.79 | AHCY (0.40) | ADORA2AAHCYADORA1ADORA2BPDE8B | |
| SCHEMBL21504439 | 0.76 | PDE8B (0.52) | ADORA2AAHCYADORA1ADORA2BPDE8B | |
| SCHEMBL14201625 | 0.76 | ADORA2A (0.57) | ADORA2AAHCYADORA1ADORA2BPDE8B | |
| SCHEMBL8910616 | 0.75 | CYP3A4 (0.51) | ADORA2AAHCYPDE8B | |
| (S)-Dhpa SCHEMBL936287 | 0.75 | AHCY (1.00) | ADORA2AAHCYADORA1ADORA2BALDH1A1 | |
| (S)-Dhpa SCHEMBL936286 | 0.75 | AHCY (1.00) | ADORA2AAHCYADORA1ADORA2BALDH1A1 | |
| (S)-Dhpa SCHEMBL28605202 | 0.75 | AHCY (1.00) | ADORA2AAHCYADORA1ADORA2BALDH1A1 | |
| SCHEMBL13851102 | 0.74 | ADORA2A (0.53) | ADORA2AAHCYADORA1ADORA2BPDE8B | |
| SCHEMBL24236965 | 0.71 | PDE8B (0.48) | ADORA2AAHCYADORA1ADORA2BPDE8B |
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 |
|---|---|---|---|---|---|---|---|
| US-5972982-A | CONTAINING 5-TO 9-MEMBERED HETEROARYL MONO- OR BICYCLIC RING SYSTEM HAVING NO MORE THAN 1 CARBONYL CARBON IN THE RING SYSTEM; VIRICIDES, BACTERICIDES | CLARION PHARMACEUTICALS INC. (US) | 1999-10-26 | — | — | US | disclosed |