Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 3/20 | 0.50 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.49 |
| ▸ | RXFP1 | Q9HBX9 | 4/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | CASP1 | P29466 | 1/20 | 0.49 |
| ▸ | CASP7 | P55210 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | GSK3A | P49840 | 1/20 | 0.46 |
| ▸ | GSK3B | P49841 | 1/20 | 0.46 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.46 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL31215443 | 1.00 | ADORA1 (0.50) | ADORA1ADORA2AKDM4ERXFP1NPSR1 | |
| SCHEMBL7017756 | 0.88 | ADORA1 (0.55) | ADORA1ADORA2AKDM4ERXFP1NPSR1 | |
| SCHEMBL31215453 | 0.88 | ADORA1 (0.55) | ADORA1ADORA2AKDM4ERXFP1NPSR1 | |
| SCHEMBL8928275 | 0.80 | CYP3A4 (0.49) | KDM4EHSD17B10MEN1ALDH1A1KMT2A | |
| SCHEMBL26632999 | 0.77 | ADORA2A (0.60) | ADORA1ADORA2AKDM4ERXFP1NPSR1 | |
| SCHEMBL7019095 | 0.77 | ADORA1 (0.60) | ADORA1ADORA2AKDM4ERXFP1NPSR1 | |
| SCHEMBL28383673 | 0.75 | KDM4E (0.66) | ADORA1ADORA2AKDM4ERXFP1NPSR1 | |
| SCHEMBL7023837 | 0.73 | ADORA1 (0.56) | ADORA1ADORA2AKDM4ERXFP1NPSR1 | |
| SCHEMBL7016113 | 0.73 | ADORA1 (0.55) | ADORA1ADORA2AKDM4ERXFP1NPSR1 | |
| SCHEMBL31215452 | 0.72 | ADORA1 (0.54) | ADORA1ADORA2AKDM4ERXFP1NPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023213761-A1 | ADENOSINE 2A RECEPTOR MODULATORS FOR USE IN THE TREATMENT OF CANCER | UNIVERSITE DE GENEVE (CH) | 2023-11-09 | — | — | WO | disclosed |